From b73408289e875460af32c069546a588c4e5f6354 Mon Sep 17 00:00:00 2001
From: Oscar Wan <oscarwan@oriong12.stanford.edu>
Date: Tue, 23 Jun 2026 18:47:38 -0700
Subject: Add OGB T1 experiment results

---
 logs/ogbg-molbace_0.log                            | 683 ++++++++++++++++
 logs/ogbg-molbbbp_0.log                            | 647 +++++++++++++++
 logs/ogbg-molclintox_0.log                         | 756 ++++++++++++++++++
 logs/ogbg-molesol_0.log                            | 757 ++++++++++++++++++
 logs/ogbg-molfreesolv_0.log                        | 791 ++++++++++++++++++
 logs/ogbg-molhiv_T1_ns3_s0.log                     | 626 +++++++++++++++
 logs/ogbg-molhiv_T1_ns3_s1.log                     | 887 +++++++++++++++++++++
 logs/ogbg-molhiv_T1_ns3_s2.log                     | 887 +++++++++++++++++++++
 logs/ogbg-mollipo_0.log                            | 828 +++++++++++++++++++
 logs/ogbg-molsider_0.log                           | 791 ++++++++++++++++++
 logs/ogbg-moltox21_0.log                           | 720 +++++++++++++++++
 ...-molbace_appnp_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbace_arma_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbace_arma_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbace_cheb_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbace_film_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbace_film_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molbace_gatv2_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbace_gcn_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbace_gen_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbace_gin_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbace_gine_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbace_gine_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bace_graphconv_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...e_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bace_graphsage_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...e_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...gbg-molbace_mf_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbace_pna_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lbace_resgated_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...ce_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbace_sgc_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbace_tag_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...ce_transformer_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...transformer_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molbbbp_appnp_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbbbp_arma_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbbbp_cheb_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbbbp_film_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbbbp_gen_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbbbp_gin_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molbbbp_gine_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bbbp_graphconv_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...p_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bbbp_graphsage_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...p_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...gbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbbbp_pna_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lbbbp_resgated_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...bp_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molbbbp_tag_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bp_transformer_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...transformer_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lclintox_appnp_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...intox_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olclintox_arma_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lintox_arma_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olclintox_cheb_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olclintox_film_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lintox_film_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lclintox_gatv2_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...intox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molclintox_gcn_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...clintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molclintox_gen_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...clintox_gen_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molclintox_gin_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...clintox_gin_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olclintox_gine_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lintox_gine_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...ntox_graphconv_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...x_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...ntox_graphsage_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...x_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molclintox_mf_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molclintox_pna_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...clintox_pna_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...intox_resgated_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...ox_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molclintox_sgc_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...clintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molclintox_tag_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...clintox_tag_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...ox_transformer_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...transformer_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molesol_appnp_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molesol_arma_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olesol_arma_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molesol_cheb_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molesol_film_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olesol_film_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molesol_gatv2_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molesol_gcn_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molesol_gen_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molesol_gin_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molesol_gine_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...olesol_gine_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...esol_graphconv_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...l_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...esol_graphsage_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...l_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...gbg-molesol_mf_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molesol_pna_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lesol_resgated_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...ol_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molesol_sgc_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...bg-molesol_tag_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...ol_transformer_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...transformer_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...freesolv_appnp_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...esolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lfreesolv_arma_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...eesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lfreesolv_cheb_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...eesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lfreesolv_film_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...eesolv_film_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...freesolv_gatv2_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...esolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olfreesolv_gcn_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...reesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olfreesolv_gen_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...reesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olfreesolv_gin_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...reesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lfreesolv_gine_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...eesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...solv_graphconv_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...v_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...solv_graphsage_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...v_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molfreesolv_mf_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...freesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olfreesolv_pna_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...reesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...esolv_resgated_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...lv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olfreesolv_sgc_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...reesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olfreesolv_tag_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...reesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...lv_transformer_classic_T0_ns1_h128_e100_s0.json |  38 +
 ...transformer_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molhiv_appnp_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...g-molhiv_appnp_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...olhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...olhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...bg-molhiv_arma_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...bg-molhiv_arma_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...bg-molhiv_cheb_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...bg-molhiv_cheb_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...bg-molhiv_film_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...bg-molhiv_film_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...g-molhiv_gatv2_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...g-molhiv_gatv2_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...olhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...olhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...olhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...gbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...gbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...gbg-molhiv_gen_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...gbg-molhiv_gen_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...gbg-molhiv_gin_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...gbg-molhiv_gin_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...bg-molhiv_gine_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...bg-molhiv_gine_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...lhiv_graphconv_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...lhiv_graphconv_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...v_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...v_graphconv_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...v_graphconv_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...lhiv_graphsage_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...lhiv_graphsage_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...v_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...v_graphsage_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
 ...v_graphsage_fixed-rrog_T1_ns3_h128_e100_s2.json |  38 +
 ...ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1.json |  38 +
 ...ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2.json |  38 +
 ...g-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json |  38 +
 ...g-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1.json |  38 +
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 create mode 100644 runs/ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0.json
 create mode 100644 runs/ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json

diff --git a/logs/ogbg-molbace_0.log b/logs/ogbg-molbace_0.log
new file mode 100644
index 0000000..6a66adb
--- /dev/null
+++ b/logs/ogbg-molbace_0.log
@@ -0,0 +1,683 @@
+[run] ogbg-molbace view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/bace.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 2616.53it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/bace.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 1513/1513 [00:00<00:00, 143288.97it/s]
+Converting graphs into PyG objects...
+
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100%|██████████| 1513/1513 [00:00<00:00, 86863.43it/s]
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/ogb/graphproppred/dataset_pyg.py:156: UserWarning: The given NumPy array is not writable, and PyTorch does not support non-writable tensors. This means writing to this tensor will result in undefined behavior. You may want to copy the array to protect its data or make it writable before converting it to a tensor. This type of warning will be suppressed for the rest of this program. (Triggered internally at /pytorch/torch/csrc/utils/tensor_numpy.cpp:203.)
+  g.y = torch.from_numpy(graph_label[i]).view(1,-1).to(torch.long)
+Done!
+Saving...
+ep10 val_rocauc=0.65055 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61502 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.64872 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.64176 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.63370 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.63040 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.64359 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.64615 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.64799 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.65201 halt=0.00 train_steps=1.00
+[ogbg-molbace_gin_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rocauc': 0.652014652014652} test={'rocauc': 0.7336115458181186} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.43810 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.62821 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.57289 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.63077 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.64469 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.57070 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.63480 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.65385 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.64029 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.64469 halt=0.00 train_steps=3.00
+[ogbg-molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.6538461538461539} test={'rocauc': 0.7169187967310032} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.55385 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61978 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.66410 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.58571 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61868 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.60183 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.60403 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.63297 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.63004 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.62821 halt=0.00 train_steps=1.00
+[ogbg-molbace_gine_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.6641025641025642} test={'rocauc': 0.7454355764214919} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.56447 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.64249 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.58901 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.66850 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.64945 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.63516 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.64469 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.63150 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.61941 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.62308 halt=0.00 train_steps=3.00
+[ogbg-molbace_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.6684981684981685} test={'rocauc': 0.6993566336289341} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.57326 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.60037 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.63773 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.62161 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.63810 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.60842 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.60916 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61282 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61429 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61209 halt=0.00 train_steps=1.00
+[ogbg-molbace_gcn_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.638095238095238} test={'rocauc': 0.7393496783168144} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.55128 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.63114 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.59817 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.63736 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.63040 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.62381 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.61648 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61978 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.61282 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61502 halt=0.00 train_steps=3.00
+[ogbg-molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.6373626373626374} test={'rocauc': 0.7732568249000173} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60696 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.60989 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.65824 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.65531 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.67582 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.66667 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.67363 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.66630 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.67143 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.66960 halt=0.00 train_steps=1.00
+[ogbg-molbace_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.6758241758241759} test={'rocauc': 0.7758650669448792} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60696 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.64469 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.67033 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.62894 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.63260 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.64835 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.63956 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.64982 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.64432 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.64762 halt=0.00 train_steps=3.00
+[ogbg-molbace_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.6703296703296704} test={'rocauc': 0.7118761954442706} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.59963 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.66227 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61795 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.64286 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.65897 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.70183 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.70293 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.68755 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.68718 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.69011 halt=0.00 train_steps=1.00
+[ogbg-molbace_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rocauc': 0.702930402930403} test={'rocauc': 0.7400452095287776} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.65238 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.59597 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.70256 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.67692 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.70256 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.69048 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.66777 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.67656 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.67509 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.67326 halt=0.00 train_steps=3.00
+[ogbg-molbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7025641025641026} test={'rocauc': 0.751869240132151} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.64652 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.73114 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.70586 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.67289 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.64945 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.66886 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.67546 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.66374 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.65934 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.65934 halt=0.00 train_steps=1.00
+[ogbg-molbace_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.7311355311355311} test={'rocauc': 0.8035124326204138} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.61722 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.70916 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.69634 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74615 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.61136 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.63260 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.64286 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.64029 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.65128 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.65092 halt=0.00 train_steps=3.00
+[ogbg-molbace_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.7461538461538462} test={'rocauc': 0.7982959485306903} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.61355 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61465 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.60403 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.58242 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.64469 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.64652 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.66484 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.66044 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.66630 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.66593 halt=0.00 train_steps=1.00
+[ogbg-molbace_transformer_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rocauc': 0.6663003663003664} test={'rocauc': 0.7363936706659711} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.54286 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.62234 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.62967 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.64469 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62491 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.67179 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.68938 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.69487 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.69817 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.69744 halt=0.00 train_steps=3.00
+[ogbg-molbace_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rocauc': 0.6981684981684982} test={'rocauc': 0.7487393496783169} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.61758 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.61758 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.58608 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.67582 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.72784 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.68278 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.72711 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.73810 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.75165 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.75092 halt=0.00 train_steps=1.00
+[ogbg-molbace_pna_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rocauc': 0.7516483516483518} test={'rocauc': 0.6911841418883674} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.50256 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.40623 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.53407 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.54249 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.62051 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.63736 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.68095 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.70220 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.70110 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.70366 halt=0.00 train_steps=3.00
+[ogbg-molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rocauc': 0.7036630036630036} test={'rocauc': 0.7967310033037731} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60293 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.63663 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.59158 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.61209 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.69158 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.69744 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.71099 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.71282 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.71026 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.71136 halt=0.00 train_steps=1.00
+[ogbg-molbace_gen_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rocauc': 0.7128205128205128} test={'rocauc': 0.7325682490001738} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.68938 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.62747 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.64029 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.62381 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.58425 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61575 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.61319 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61795 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.62161 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61941 halt=0.00 train_steps=3.00
+[ogbg-molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.6893772893772894} test={'rocauc': 0.7449139280125194} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.63150 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.64615 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.65128 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.64396 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.63443 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.67033 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.66081 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.66740 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.65678 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.65824 halt=0.00 train_steps=1.00
+[ogbg-molbace_film_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.6703296703296703} test={'rocauc': 0.7242218744566161} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60513 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.66520 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.62747 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.61795 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.66081 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.64432 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.64396 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.63553 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.65055 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.65348 halt=0.00 train_steps=3.00
+[ogbg-molbace_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.6652014652014652} test={'rocauc': 0.7242218744566163} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.67216 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.67875 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.70659 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.65238 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.65275 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.71722 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.69670 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.71136 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.71355 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.71282 halt=0.00 train_steps=1.00
+[ogbg-molbace_resgated_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.7172161172161172} test={'rocauc': 0.7876890975482524} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.66777 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.60293 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.63663 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.66813 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.65788 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.68462 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.69121 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.67582 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.68388 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.68168 halt=0.00 train_steps=3.00
+[ogbg-molbace_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.6912087912087912} test={'rocauc': 0.7464788732394366} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.70842 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.59634 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.60842 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.63260 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.66374 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.62308 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.65897 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.65568 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.65128 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.65092 halt=0.00 train_steps=1.00
+[ogbg-molbace_tag_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.7084249084249085} test={'rocauc': 0.7344809598330725} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.73553 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.63150 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.63956 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.67289 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.67216 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.70037 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.69231 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.70073 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.69963 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.70110 halt=0.00 train_steps=3.00
+[ogbg-molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.7355311355311356} test={'rocauc': 0.6805772909059293} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.65751 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.54212 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.60842 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.59414 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61355 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.60916 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.59451 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.60476 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.60549 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.60586 halt=0.00 train_steps=1.00
+[ogbg-molbace_sgc_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.6575091575091575} test={'rocauc': 0.6965745087810815} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60659 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.62894 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.55641 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.64542 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62491 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61538 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.61429 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61026 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.60513 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.60220 halt=0.00 train_steps=3.00
+[ogbg-molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.6454212454212455} test={'rocauc': 0.772735176491045} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.72674 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.70037 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.67546 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.67289 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.65641 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.69634 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.69011 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.70220 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.70073 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.69890 halt=0.00 train_steps=1.00
+[ogbg-molbace_cheb_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.7267399267399268} test={'rocauc': 0.7969048861067639} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.67289 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69011 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.71136 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.67546 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.69853 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.68901 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.70000 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.70366 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.70403 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.70293 halt=0.00 train_steps=3.00
+[ogbg-molbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7113553113553114} test={'rocauc': 0.7532603025560771} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.58132 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.64139 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.58608 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.65751 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.69231 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.66593 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.66300 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.66630 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.66777 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.66850 halt=0.00 train_steps=1.00
+[ogbg-molbace_arma_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.6923076923076924} test={'rocauc': 0.7838636758824552} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.69744 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.66667 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.68425 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.66740 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71795 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.71429 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.69451 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.70220 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.69744 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.69560 halt=0.00 train_steps=3.00
+[ogbg-molbace_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.717948717948718} test={'rocauc': 0.7671709267953399} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.66960 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.59158 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.69853 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.72088 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.71282 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.72491 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.71905 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.74212 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.73260 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.73223 halt=0.00 train_steps=1.00
+[ogbg-molbace_mf_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rocauc': 0.7421245421245422} test={'rocauc': 0.7760389497478699} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.65641 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.70293 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.70366 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.71062 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.69414 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.72271 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.72344 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.72271 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.72234 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.72125 halt=0.00 train_steps=3.00
+[ogbg-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.7234432234432234} test={'rocauc': 0.7683881064162754} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbace view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.65641 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.54982 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.64652 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.60440 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.65275 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61172 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.61209 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.60623 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61172 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61465 halt=0.00 train_steps=1.00
+[ogbg-molbace_appnp_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.6564102564102564} test={'rocauc': 0.7423056859676577} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbace view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbace --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.69560 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.59121 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.71685 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.67949 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62747 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.64505 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.66337 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.65531 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.64615 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.64762 halt=0.00 train_steps=3.00
+[ogbg-molbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7168498168498169} test={'rocauc': 0.7209181011997913} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
diff --git a/logs/ogbg-molbbbp_0.log b/logs/ogbg-molbbbp_0.log
new file mode 100644
index 0000000..c0bb356
--- /dev/null
+++ b/logs/ogbg-molbbbp_0.log
@@ -0,0 +1,647 @@
+[run] ogbg-molbbbp view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/bbbp.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 1168.17it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/bbbp.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 2039/2039 [00:00<00:00, 165147.94it/s]
+Converting graphs into PyG objects...
+
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100%|██████████| 2039/2039 [00:00<00:00, 59985.45it/s]
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/ogb/graphproppred/dataset_pyg.py:156: UserWarning: The given NumPy array is not writable, and PyTorch does not support non-writable tensors. This means writing to this tensor will result in undefined behavior. You may want to copy the array to protect its data or make it writable before converting it to a tensor. This type of warning will be suppressed for the rest of this program. (Triggered internally at /pytorch/torch/csrc/utils/tensor_numpy.cpp:203.)
+  g.y = torch.from_numpy(graph_label[i]).view(1,-1).to(torch.long)
+Done!
+Saving...
+ep10 val_rocauc=0.92512 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.89933 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.88519 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91098 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.88191 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.88041 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.89565 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.89933 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.90172 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.90202 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_gin_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.925121975505327} test={'rocauc': 0.5670331790123456} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.95260 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.93299 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92502 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.88410 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.91736 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.92522 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92801 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.92373 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.92243 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.92512 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9526038036443294} test={'rocauc': 0.5931712962962963} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.82535 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.88788 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.91138 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.93239 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91825 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.90810 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.89137 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.90959 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.90441 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.90690 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_gine_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.932390719904411} test={'rocauc': 0.6160300925925926} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.91397 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.90710 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.85363 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.94215 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.90471 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.90909 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.90043 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.90252 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.90103 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90441 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9421487603305785} test={'rocauc': 0.6976273148148147} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.91297 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92891 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.92940 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.93856 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92164 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92881 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.93110 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.93269 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.93080 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.93299 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.9385641740515782} test={'rocauc': 0.667920524691358} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.94165 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.92293 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.90919 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92632 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92940 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.91546 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92642 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.92811 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.92701 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.92592 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9416509011251619} test={'rocauc': 0.601658950617284} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.94832 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92034 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.93498 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91576 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91945 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.91477 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.90999 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.90750 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.90481 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.90232 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9483222144777457} test={'rocauc': 0.628761574074074} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.87882 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.95021 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92104 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92144 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.93488 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.93777 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.93199 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.93528 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.93269 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.93468 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.9502140794583291} test={'rocauc': 0.5933641975308641} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.92393 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.93349 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.91238 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.93468 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91507 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92990 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.92960 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.93000 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.92901 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.92851 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.9346808722493279} test={'rocauc': 0.6324266975308642} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.88251 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.90780 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.93558 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.93528 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92154 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.92632 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92442 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.92592 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.92482 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.92263 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.935577018819078} test={'rocauc': 0.6559606481481481} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.92204 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92681 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.89087 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.89625 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92034 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92024 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.91377 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.91745 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.91676 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91686 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.9268146968037438} test={'rocauc': 0.5899884259259258} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93369 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.93279 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.91566 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92204 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92891 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.91805 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92363 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.91795 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.91536 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.91307 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9336851538384945} test={'rocauc': 0.6518132716049383} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.94952 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.93538 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.94613 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.94553 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.93259 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.93657 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.93458 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.93428 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.93339 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.93299 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_transformer_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9495170765707458} test={'rocauc': 0.6156442901234568} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93548 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.91516 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92582 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.91775 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92174 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.92871 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92164 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.92134 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.92004 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.92024 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9354774469779946} test={'rocauc': 0.6221064814814815} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.91188 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.88977 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.90929 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.92134 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.90869 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.95539 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.93130 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.92213 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.91795 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.92174 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_pna_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.955391815194663} test={'rocauc': 0.6417824074074073} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.88579 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.90571 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.80783 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.95848 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.93478 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.94474 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.92841 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.92413 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.91487 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.91875 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9584785422682465} test={'rocauc': 0.6682098765432098} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.89943 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92104 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.92502 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.95489 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92213 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.93408 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.93717 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.93777 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.93797 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.93777 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_gen_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.9548939559892462} test={'rocauc': 0.677469135802469} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93657 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.92353 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92452 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.94295 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92174 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.93578 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.94036 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.93976 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.93856 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.93737 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9429453350592453} test={'rocauc': 0.6036844135802468} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.83919 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.85024 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.89167 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91128 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92851 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92303 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.91616 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.91387 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.91407 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91596 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_film_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.9285074181021606} test={'rocauc': 0.6300154320987654} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90122 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.93996 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.91477 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.90312 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.90252 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.90630 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.90959 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.90282 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.90182 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90252 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.939958179826745} test={'rocauc': 0.6323302469135803} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.88957 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.91477 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.87743 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.88967 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91825 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.91158 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.90630 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.91238 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.91078 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91317 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_resgated_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.9182515184705764} test={'rocauc': 0.6626157407407406} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93807 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.95350 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92034 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92124 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.89057 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.89893 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.90401 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.90620 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.90531 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90381 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.9534999502140794} test={'rocauc': 0.583912037037037} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93369 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92253 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.93607 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.94763 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92801 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.93677 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.93617 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.93299 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.93319 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.93329 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_tag_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.9476252115901622} test={'rocauc': 0.6099537037037036} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.91367 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.94265 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.94593 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92960 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.91915 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.91526 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92064 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.91775 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.91895 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.91805 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.9459324902917455} test={'rocauc': 0.6419753086419753} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90381 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92104 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.90272 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91048 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92313 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.93000 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.92044 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.91775 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.91566 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91556 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.9300009957184109} test={'rocauc': 0.6239390432098766} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.91736 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.88111 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92831 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.91905 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92851 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.91636 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92004 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.91616 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.91526 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.91556 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.9285074181021606} test={'rocauc': 0.6454475308641976} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.91925 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.94524 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.92084 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91377 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91497 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92353 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.91925 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.91726 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.92114 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.92154 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_cheb_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.9452354874041621} test={'rocauc': 0.6514274691358024} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90152 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.91805 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92313 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92781 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92423 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.92433 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.91975 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.91755 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.91835 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.91855 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9278104152145773} test={'rocauc': 0.665895061728395} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93667 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.90013 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.91367 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.86598 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.88948 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.88997 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.88858 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.88997 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.88938 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.89057 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_arma_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9366723090709947} test={'rocauc': 0.6651234567901235} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.94145 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.85263 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.91646 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.89485 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.93100 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.90919 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.91218 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.91367 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.91546 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.91427 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.941451757442995} test={'rocauc': 0.6634837962962963} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.91048 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.91984 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.93090 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.93946 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92323 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92672 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.92333 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.92084 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.92004 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91805 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.9394603206213283} test={'rocauc': 0.6364776234567902} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.88619 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.94882 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.93797 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.91238 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.92522 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.93229 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.92930 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.92821 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.92811 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.92652 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.9488200736831625} test={'rocauc': 0.6480516975308641} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molbbbp view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90122 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.91467 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.88539 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.89416 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.88330 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.89246 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.88788 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.88898 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.89425 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.89167 halt=0.00 train_steps=1.00
+[ogbg-molbbbp_appnp_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.9146669321915762} test={'rocauc': 0.6387924382716049} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molbbbp view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molbbbp --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93598 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.90202 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92014 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.93189 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.91188 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.91248 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.90272 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.89844 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.90680 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90620 halt=0.00 train_steps=3.00
+[ogbg-molbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9359753061834113} test={'rocauc': 0.6073495370370371} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
diff --git a/logs/ogbg-molclintox_0.log b/logs/ogbg-molclintox_0.log
new file mode 100644
index 0000000..71cb703
--- /dev/null
+++ b/logs/ogbg-molclintox_0.log
@@ -0,0 +1,756 @@
+[run] ogbg-molclintox view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/clintox.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 1750.18it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/clintox.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 1477/1477 [00:00<00:00, 90670.73it/s]
+Converting graphs into PyG objects...
+
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100%|██████████| 1477/1477 [00:00<00:00, 68546.06it/s]
+Done!
+Saving...
+ep10 val_rocauc=0.83043 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.84184 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.95471 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.93925 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.92535 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.94904 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.93532 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.92022 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.93040 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.92970 halt=0.00 train_steps=1.00
+[ogbg-molclintox_gin_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.9547104304146558} test={'rocauc': 0.8586383067459077} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.83909 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.83210 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.81964 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.84041 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.87796 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.89288 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.91569 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.91639 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.91030 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90596 halt=0.00 train_steps=3.00
+[ogbg-molclintox_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.9163892445582587} test={'rocauc': 0.8788013067806625} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77703 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.89547 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.93305 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.93277 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.93526 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.91819 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.89099 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.90036 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.89695 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.89952 halt=0.00 train_steps=1.00
+[ogbg-molclintox_gine_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.9352564102564103} test={'rocauc': 0.8869330622458556} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.85987 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.85202 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92254 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.90400 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.82272 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.90346 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.86070 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.86354 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.85770 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.85969 halt=0.00 train_steps=3.00
+[ogbg-molclintox_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.9225425982468236} test={'rocauc': 0.8839597886907865} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90793 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.89688 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.89512 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.90011 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.90978 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.93185 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.92404 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.91820 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.92788 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.92799 halt=0.00 train_steps=1.00
+[ogbg-molclintox_gcn_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.9318477297350538} test={'rocauc': 0.8932080422618427} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90811 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.90232 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.85310 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.87060 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.90973 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.90737 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.89160 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.90489 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.90900 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90818 halt=0.00 train_steps=3.00
+[ogbg-molclintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.909733576282872} test={'rocauc': 0.8791896917248809} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90614 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.86131 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.91430 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.90922 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.88325 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.89701 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.89525 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.88834 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.88706 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.88764 halt=0.00 train_steps=1.00
+[ogbg-molclintox_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.9143020125414492} test={'rocauc': 0.8881694644284572} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.95791 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.84252 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92818 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.93544 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.91088 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.88493 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.88421 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.87990 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.87311 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.87498 halt=0.00 train_steps=3.00
+[ogbg-molclintox_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.957908171640566} test={'rocauc': 0.8664451047857367} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.84476 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.95149 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.91646 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.86488 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.87970 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.89911 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.86614 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.87327 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.87467 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.87408 halt=0.00 train_steps=1.00
+[ogbg-molclintox_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.9514880659246856} test={'rocauc': 0.849258853786536} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.88147 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.91892 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.93508 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.87244 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.89978 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.91147 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.90529 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.89732 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.89978 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.90107 halt=0.00 train_steps=3.00
+[ogbg-molclintox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.9350807643061164} test={'rocauc': 0.8328163556111632} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.86711 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.85132 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.89173 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.85924 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.85122 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.85203 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.85169 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.85318 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.86031 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.85341 halt=0.00 train_steps=1.00
+[ogbg-molclintox_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.8917274040513478} test={'rocauc': 0.850132937128558} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.84747 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76048 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.82325 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.84937 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.79834 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.82018 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.79431 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.78760 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.78724 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.79087 halt=0.00 train_steps=3.00
+[ogbg-molclintox_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.849372106766473} test={'rocauc': 0.8185512459597539} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.92705 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.88443 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.90818 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.87958 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.86168 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.85327 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.85162 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.84566 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.84519 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.84647 halt=0.00 train_steps=1.00
+[ogbg-molclintox_transformer_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9270511178961884} test={'rocauc': 0.8763771591422514} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.93220 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.89666 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.87739 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.85882 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.87220 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.86733 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.85830 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.85875 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.85945 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.86015 halt=0.00 train_steps=3.00
+[ogbg-molclintox_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9321957385337667} test={'rocauc': 0.8521686998227505} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.92859 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.80558 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.86447 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.88785 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.89099 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.82869 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.86585 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.86096 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.86236 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.86669 halt=0.00 train_steps=1.00
+[ogbg-molclintox_pna_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9285867887980563} test={'rocauc': 0.8602891599763668} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.90641 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.74479 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.80852 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.89954 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.82959 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.80479 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.80490 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.80773 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.77999 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.78094 halt=0.00 train_steps=3.00
+[ogbg-molclintox_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.9064094356347877} test={'rocauc': 0.8734968546901609} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.98202 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.88923 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.88643 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91053 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.86987 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.85782 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.88061 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.85117 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.83901 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.83713 halt=0.00 train_steps=1.00
+[ogbg-molclintox_gen_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9820184510325356} test={'rocauc': 0.8127689153025406} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90138 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.93158 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.93989 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92932 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.88558 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.87502 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.85864 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.84902 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.83837 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.83591 halt=0.00 train_steps=3.00
+[ogbg-molclintox_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.9398880462260745} test={'rocauc': 0.8194027386786223} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.90481 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.86948 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.85559 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.87663 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.87551 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.87420 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.86984 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.87219 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.86844 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.86914 halt=0.00 train_steps=1.00
+[ogbg-molclintox_film_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9048138481237074} test={'rocauc': 0.7730589441490285} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.88496 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.91233 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.92508 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.93170 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.94537 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.94106 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.93919 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.94293 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.94003 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.93757 halt=0.00 train_steps=3.00
+[ogbg-molclintox_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.9453700055812732} test={'rocauc': 0.8429647586278803} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.87012 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.92438 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.86702 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.91514 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91738 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.92406 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.90505 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.90496 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.91198 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91140 halt=0.00 train_steps=1.00
+[ogbg-molclintox_resgated_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.9243803145211595} test={'rocauc': 0.9184252597921663} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.88666 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.86182 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.87936 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.90554 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.88316 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.87763 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.86391 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.86179 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.86274 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.86226 halt=0.00 train_steps=3.00
+[ogbg-molclintox_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9055377720870679} test={'rocauc': 0.8978999409168318} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.92366 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.87789 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.88531 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.87445 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.84911 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.82478 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.81727 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.82848 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.81903 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.81763 halt=0.00 train_steps=1.00
+[ogbg-molclintox_tag_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.923656390557799} test={'rocauc': 0.7998149306641643} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.80381 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.90305 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.82746 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.91828 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.89686 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.87545 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.86013 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.84718 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.84695 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.84320 halt=0.00 train_steps=3.00
+[ogbg-molclintox_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9182762073607145} test={'rocauc': 0.8432784207416675} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.81420 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.87330 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.88533 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.89801 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.90011 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.90184 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.91949 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.90453 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.90570 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.90441 halt=0.00 train_steps=1.00
+[ogbg-molclintox_sgc_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rocauc': 0.9194852096260546} test={'rocauc': 0.8985793973516839} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.80217 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.86031 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.89787 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.92197 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.89216 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.88502 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.87652 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.86729 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.88099 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.87993 halt=0.00 train_steps=3.00
+[ogbg-molclintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9219696969696969} test={'rocauc': 0.9054147985959059} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.87442 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.88236 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.89279 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.85328 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.85443 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.84836 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.84369 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.84240 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.83936 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.83877 halt=0.00 train_steps=1.00
+[ogbg-molclintox_cheb_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.8927886667323287} test={'rocauc': 0.9152165224342266} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.87090 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.87367 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.80362 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.86133 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.88164 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.86596 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.85975 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.85354 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.84862 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.85259 halt=0.00 train_steps=3.00
+[ogbg-molclintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.8816384319905446} test={'rocauc': 0.8982283738226811} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77612 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.90207 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.92264 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.94629 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91352 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.93214 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.92302 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.92090 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.91950 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.91891 halt=0.00 train_steps=1.00
+[ogbg-molclintox_arma_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.9462941987589875} test={'rocauc': 0.8678231327981094} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.84999 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.88115 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.88909 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.85445 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.91353 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.89471 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.89647 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.88417 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.88465 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.88336 halt=0.00 train_steps=3.00
+[ogbg-molclintox_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.9135288420499689} test={'rocauc': 0.8863352796024051} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.92515 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.89990 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.92116 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.89706 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.91531 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.90167 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.89661 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.89602 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.89731 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.89672 halt=0.00 train_steps=1.00
+[ogbg-molclintox_mf_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.9251534850126399} test={'rocauc': 0.8369808501025267} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.81387 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.91473 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.91089 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.91420 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.86880 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.88485 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.87498 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.86526 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.85986 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.85916 halt=0.00 train_steps=3.00
+[ogbg-molclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.9147271742342165} test={'rocauc': 0.804700587356202} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molclintox view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74829 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.82319 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.79624 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.80150 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.84421 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.85159 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.83837 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.84119 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.83171 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.83499 halt=0.00 train_steps=1.00
+[ogbg-molclintox_appnp_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.8515931251846744} test={'rocauc': 0.9184287352726515} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molclintox view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molclintox --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77085 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.89489 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.84491 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.90294 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.87489 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.87412 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.88602 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.88457 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.87652 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.87735 halt=0.00 train_steps=3.00
+[ogbg-molclintox_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.9029408385042188} test={'rocauc': 0.8898090223473396} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molclintox_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8251 (0.0330) | 0.7725 (-0.0117) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7740 (0.0210) | 0.7590 (0.0276) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-molesol_0.log b/logs/ogbg-molesol_0.log
new file mode 100644
index 0000000..8cd6dec
--- /dev/null
+++ b/logs/ogbg-molesol_0.log
@@ -0,0 +1,757 @@
+[run] ogbg-molesol view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/esol.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 9198.04it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/esol.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
  0%|          | 0/1128 [00:00<?, ?it/s]
100%|██████████| 1128/1128 [00:00<00:00, 161760.63it/s]
+Converting graphs into PyG objects...
+
  0%|          | 0/1128 [00:00<?, ?it/s]
100%|██████████| 1128/1128 [00:00<00:00, 90847.86it/s]
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/ogb/graphproppred/dataset_pyg.py:158: UserWarning: The given NumPy array is not writable, and PyTorch does not support non-writable tensors. This means writing to this tensor will result in undefined behavior. You may want to copy the array to protect its data or make it writable before converting it to a tensor. This type of warning will be suppressed for the rest of this program. (Triggered internally at /pytorch/torch/csrc/utils/tensor_numpy.cpp:203.)
+  g.y = torch.from_numpy(graph_label[i]).view(1,-1).to(torch.float32)
+Done!
+Saving...
+ep10 val_rmse=1.55132 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.85249 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.28538 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.16869 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.06721 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.01867 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.04139 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.04699 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.04597 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.05181 halt=0.00 train_steps=1.00
+[ogbg-molesol_gin_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rmse': np.float32(1.018667)} test={'rmse': np.float32(0.9899856)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.15780 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.74314 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.18904 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.98340 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.06552 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.97743 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.97563 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.96466 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.97039 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.97051 halt=0.00 train_steps=3.00
+[ogbg-molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.9646594)} test={'rmse': np.float32(1.0798396)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.71976 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.59364 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.05039 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.08315 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.24026 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.16317 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.03410 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.04083 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.03215 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.02862 halt=0.00 train_steps=1.00
+[ogbg-molesol_gine_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rmse': np.float32(1.0286155)} test={'rmse': np.float32(1.0806612)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.49705 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.28800 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.52334 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.35057 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.06045 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.09347 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.06311 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.08356 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.06803 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.05808 halt=0.00 train_steps=3.00
+[ogbg-molesol_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rmse': np.float32(1.0580767)} test={'rmse': np.float32(1.0950748)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.27627 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.05226 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.11377 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.04089 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.13518 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.04774 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.05628 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.06343 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.05586 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.05581 halt=0.00 train_steps=1.00
+[ogbg-molesol_gcn_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rmse': np.float32(1.040891)} test={'rmse': np.float32(1.1161426)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.07314 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.12097 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.98673 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.97671 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.00746 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.99924 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.97496 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.95908 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.98357 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.98355 halt=0.00 train_steps=3.00
+[ogbg-molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.9590842)} test={'rmse': np.float32(0.9305291)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.03649 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.00381 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.04979 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.96911 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.99778 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.99357 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.97284 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.96802 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.97458 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.97439 halt=0.00 train_steps=1.00
+[ogbg-molesol_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.9680215)} test={'rmse': np.float32(1.0037521)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.08617 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.99342 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.16581 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.07873 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.12930 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.04825 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.07985 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.08909 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.07709 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.08338 halt=0.00 train_steps=3.00
+[ogbg-molesol_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rmse': np.float32(0.9934181)} test={'rmse': np.float32(1.0794438)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.24588 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.12725 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.03778 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.22700 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.08767 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.07285 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.05946 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.03678 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.06707 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.07297 halt=0.00 train_steps=1.00
+[ogbg-molesol_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(1.0367837)} test={'rmse': np.float32(0.9878302)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.14944 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.07425 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.01105 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.00182 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.08651 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.00579 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.06140 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.05534 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.06903 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.07107 halt=0.00 train_steps=3.00
+[ogbg-molesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(1.001817)} test={'rmse': np.float32(0.97798175)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=2.15562 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.01649 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.07876 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.13149 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.11394 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.04659 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.00497 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.99220 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.97410 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.97473 halt=0.00 train_steps=1.00
+[ogbg-molesol_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.97409904)} test={'rmse': np.float32(0.97323257)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.59797 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.52589 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.26935 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.00482 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.04145 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.11448 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.11833 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.07841 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.09266 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.10812 halt=0.00 train_steps=3.00
+[ogbg-molesol_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(1.0048155)} test={'rmse': np.float32(0.9968388)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.03814 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.00847 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.96101 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.95978 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.97335 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.97677 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.93977 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.95833 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.95792 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.95845 halt=0.00 train_steps=1.00
+[ogbg-molesol_transformer_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.9397741)} test={'rmse': np.float32(0.9491862)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.06235 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.00463 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.98407 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.03132 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.98438 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.02566 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.01917 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.04620 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.05332 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.04784 halt=0.00 train_steps=3.00
+[ogbg-molesol_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rmse': np.float32(0.9840657)} test={'rmse': np.float32(1.0003974)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rmse=1.65394 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.25086 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.22408 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.52592 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.95818 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.93502 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.91648 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.91764 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.91157 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.92239 halt=0.00 train_steps=1.00
+[ogbg-molesol_pna_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.91156536)} test={'rmse': np.float32(0.91526616)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rmse=1.04130 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.11945 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.16403 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.31558 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.98405 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.99907 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.04776 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.07359 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.09525 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.07509 halt=0.00 train_steps=3.00
+[ogbg-molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rmse': np.float32(0.98405296)} test={'rmse': np.float32(0.9092428)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.08524 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.05132 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.03850 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.00889 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.05118 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.03397 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.05106 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.06416 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.07429 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.07824 halt=0.00 train_steps=1.00
+[ogbg-molesol_gen_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rmse': np.float32(1.0088853)} test={'rmse': np.float32(0.87622714)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.11115 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.21492 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.01682 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.08134 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.00267 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.06206 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.03358 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.01448 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.01315 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.01756 halt=0.00 train_steps=3.00
+[ogbg-molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rmse': np.float32(1.0026727)} test={'rmse': np.float32(0.92061317)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.76181 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.52145 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.27713 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.21887 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.11418 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.08223 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.07944 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.08273 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.07177 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.07711 halt=0.00 train_steps=1.00
+[ogbg-molesol_film_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(1.0717738)} test={'rmse': np.float32(1.2896088)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.47310 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.62945 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.15701 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.21397 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.06834 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.03025 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.14875 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.01964 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.02214 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.03526 halt=0.00 train_steps=3.00
+[ogbg-molesol_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(1.0196408)} test={'rmse': np.float32(1.084922)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.13044 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.07395 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.97508 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.08038 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.01758 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.94915 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.96798 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.01548 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.99474 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.99260 halt=0.00 train_steps=1.00
+[ogbg-molesol_resgated_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rmse': np.float32(0.9491545)} test={'rmse': np.float32(0.8908002)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.11687 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.06236 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.05365 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.06597 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.05752 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.04122 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.00897 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.98734 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.99571 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.99361 halt=0.00 train_steps=3.00
+[ogbg-molesol_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.98733556)} test={'rmse': np.float32(0.8825017)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.21819 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.98698 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.93235 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.08652 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.05470 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.95672 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.95119 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.95477 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.96258 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.95642 halt=0.00 train_steps=1.00
+[ogbg-molesol_tag_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rmse': np.float32(0.9323491)} test={'rmse': np.float32(0.9677547)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.45321 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.12140 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.32783 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.08941 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.90360 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.97927 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.95696 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.94772 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.95704 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.95720 halt=0.00 train_steps=3.00
+[ogbg-molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rmse': np.float32(0.90359575)} test={'rmse': np.float32(0.94621307)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.24034 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.09760 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.08614 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.31586 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.15240 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.07828 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.10383 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.06528 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.06407 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.06170 halt=0.00 train_steps=1.00
+[ogbg-molesol_sgc_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rmse': np.float32(1.0616996)} test={'rmse': np.float32(0.9779573)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.05239 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.22334 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.01723 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.02365 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.03673 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.01829 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.03733 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.01637 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.01291 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.01402 halt=0.00 train_steps=3.00
+[ogbg-molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(1.012914)} test={'rmse': np.float32(0.93728936)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.05592 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.20034 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.04960 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.04264 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.99688 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.96500 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.98661 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.97827 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.97583 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.97404 halt=0.00 train_steps=1.00
+[ogbg-molesol_cheb_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rmse': np.float32(0.96499854)} test={'rmse': np.float32(0.8722475)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.11822 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.09404 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.94869 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.91990 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.99420 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.94945 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.94930 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.93166 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.94542 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.94151 halt=0.00 train_steps=3.00
+[ogbg-molesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(0.9198978)} test={'rmse': np.float32(0.88406515)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.17207 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.31463 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.14849 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.08189 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.10686 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.07767 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.06414 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.01946 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.03369 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.03917 halt=0.00 train_steps=1.00
+[ogbg-molesol_arma_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(1.0194643)} test={'rmse': np.float32(1.0665998)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.41924 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.34309 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.18316 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.16171 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.06878 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.11578 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.03151 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.00344 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.04059 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.04341 halt=0.00 train_steps=3.00
+[ogbg-molesol_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(1.0034424)} test={'rmse': np.float32(1.1272348)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.64768 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.55084 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.39699 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.40672 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.16995 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.26174 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.14943 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.16326 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.15271 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.15059 halt=0.00 train_steps=1.00
+[ogbg-molesol_mf_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(1.1494334)} test={'rmse': np.float32(1.0638543)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.52906 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.24056 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.22429 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.05528 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.21370 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.21516 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.11821 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.15312 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.09602 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.10826 halt=0.00 train_steps=3.00
+[ogbg-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(1.055278)} test={'rmse': np.float32(1.0367582)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molesol view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.82593 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.84712 halt=0.00 train_steps=1.00
+ep30 val_rmse=2.11191 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.78404 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.60830 halt=0.00 train_steps=1.00
+ep60 val_rmse=1.61893 halt=0.00 train_steps=1.00
+ep70 val_rmse=1.65620 halt=0.00 train_steps=1.00
+ep80 val_rmse=1.62803 halt=0.00 train_steps=1.00
+ep90 val_rmse=1.63849 halt=0.00 train_steps=1.00
+ep100 val_rmse=1.65824 halt=0.00 train_steps=1.00
+[ogbg-molesol_appnp_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rmse': np.float32(1.6082952)} test={'rmse': np.float32(1.5212218)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molesol view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molesol --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.92888 halt=0.00 train_steps=3.00
+ep20 val_rmse=2.07388 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.80534 halt=0.00 train_steps=3.00
+ep40 val_rmse=1.75562 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.86712 halt=0.00 train_steps=3.00
+ep60 val_rmse=1.53509 halt=0.00 train_steps=3.00
+ep70 val_rmse=1.49896 halt=0.00 train_steps=3.00
+ep80 val_rmse=1.47594 halt=0.00 train_steps=3.00
+ep90 val_rmse=1.43690 halt=0.00 train_steps=3.00
+ep100 val_rmse=1.41956 halt=0.00 train_steps=3.00
+[ogbg-molesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rmse': np.float32(1.4195601)} test={'rmse': np.float32(1.4928638)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8251 (0.0330) | 0.7725 (-0.0117) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7740 (0.0210) | 0.7590 (0.0276) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7923 (-0.0221) | 0.7227 (-0.0015) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7659 (0.0181) | 0.7136 (0.0117) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7717 (0.0189) | 0.7181 (-0.0074) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-molfreesolv_0.log b/logs/ogbg-molfreesolv_0.log
new file mode 100644
index 0000000..d163fe6
--- /dev/null
+++ b/logs/ogbg-molfreesolv_0.log
@@ -0,0 +1,791 @@
+[run] ogbg-molfreesolv view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/freesolv.zip
+
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+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/freesolv.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 642/642 [00:00<00:00, 168802.86it/s]
+Converting graphs into PyG objects...
+
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100%|██████████| 642/642 [00:00<00:00, 94320.05it/s]
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/ogb/graphproppred/dataset_pyg.py:158: UserWarning: The given NumPy array is not writable, and PyTorch does not support non-writable tensors. This means writing to this tensor will result in undefined behavior. You may want to copy the array to protect its data or make it writable before converting it to a tensor. This type of warning will be suppressed for the rest of this program. (Triggered internally at /pytorch/torch/csrc/utils/tensor_numpy.cpp:203.)
+  g.y = torch.from_numpy(graph_label[i]).view(1,-1).to(torch.float32)
+Done!
+Saving...
+ep10 val_rmse=4.92044 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.21001 halt=0.00 train_steps=1.00
+ep30 val_rmse=5.88032 halt=0.00 train_steps=1.00
+ep40 val_rmse=4.01899 halt=0.00 train_steps=1.00
+ep50 val_rmse=4.83673 halt=0.00 train_steps=1.00
+ep60 val_rmse=4.75203 halt=0.00 train_steps=1.00
+ep70 val_rmse=4.81207 halt=0.00 train_steps=1.00
+ep80 val_rmse=4.62906 halt=0.00 train_steps=1.00
+ep90 val_rmse=4.50698 halt=0.00 train_steps=1.00
+ep100 val_rmse=4.52164 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_gin_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rmse': np.float32(4.018989)} test={'rmse': np.float32(3.4898324)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.69277 halt=0.00 train_steps=3.00
+ep20 val_rmse=4.87275 halt=0.00 train_steps=3.00
+ep30 val_rmse=4.67094 halt=0.00 train_steps=3.00
+ep40 val_rmse=4.24027 halt=0.00 train_steps=3.00
+ep50 val_rmse=4.51482 halt=0.00 train_steps=3.00
+ep60 val_rmse=4.30742 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.98909 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.97428 halt=0.00 train_steps=3.00
+ep90 val_rmse=4.05014 halt=0.00 train_steps=3.00
+ep100 val_rmse=4.03284 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(3.974279)} test={'rmse': np.float32(3.4291606)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.86551 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.32178 halt=0.00 train_steps=1.00
+ep30 val_rmse=3.57485 halt=0.00 train_steps=1.00
+ep40 val_rmse=4.90044 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.29792 halt=0.00 train_steps=1.00
+ep60 val_rmse=3.68413 halt=0.00 train_steps=1.00
+ep70 val_rmse=3.29607 halt=0.00 train_steps=1.00
+ep80 val_rmse=3.49131 halt=0.00 train_steps=1.00
+ep90 val_rmse=3.40593 halt=0.00 train_steps=1.00
+ep100 val_rmse=3.33543 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_gine_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(3.2960742)} test={'rmse': np.float32(3.1442)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.02814 halt=0.00 train_steps=3.00
+ep20 val_rmse=4.68627 halt=0.00 train_steps=3.00
+ep30 val_rmse=5.03131 halt=0.00 train_steps=3.00
+ep40 val_rmse=4.77823 halt=0.00 train_steps=3.00
+ep50 val_rmse=4.73792 halt=0.00 train_steps=3.00
+ep60 val_rmse=4.50008 halt=0.00 train_steps=3.00
+ep70 val_rmse=4.52713 halt=0.00 train_steps=3.00
+ep80 val_rmse=4.49676 halt=0.00 train_steps=3.00
+ep90 val_rmse=4.45230 halt=0.00 train_steps=3.00
+ep100 val_rmse=4.44683 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rmse': np.float32(4.446826)} test={'rmse': np.float32(3.7405443)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.71523 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.07630 halt=0.00 train_steps=1.00
+ep30 val_rmse=3.90654 halt=0.00 train_steps=1.00
+ep40 val_rmse=3.85416 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.90803 halt=0.00 train_steps=1.00
+ep60 val_rmse=3.77325 halt=0.00 train_steps=1.00
+ep70 val_rmse=3.76295 halt=0.00 train_steps=1.00
+ep80 val_rmse=3.72133 halt=0.00 train_steps=1.00
+ep90 val_rmse=3.71725 halt=0.00 train_steps=1.00
+ep100 val_rmse=3.71896 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_gcn_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(3.717249)} test={'rmse': np.float32(2.4850736)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.78492 halt=0.00 train_steps=3.00
+ep20 val_rmse=4.13954 halt=0.00 train_steps=3.00
+ep30 val_rmse=4.05433 halt=0.00 train_steps=3.00
+ep40 val_rmse=3.93636 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.93483 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.64456 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.58876 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.59718 halt=0.00 train_steps=3.00
+ep90 val_rmse=3.62452 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.62109 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rmse': np.float32(3.5887632)} test={'rmse': np.float32(2.4443517)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.72648 halt=0.00 train_steps=1.00
+ep20 val_rmse=3.88867 halt=0.00 train_steps=1.00
+ep30 val_rmse=3.71380 halt=0.00 train_steps=1.00
+ep40 val_rmse=3.60818 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.51239 halt=0.00 train_steps=1.00
+ep60 val_rmse=3.62984 halt=0.00 train_steps=1.00
+ep70 val_rmse=3.52360 halt=0.00 train_steps=1.00
+ep80 val_rmse=3.50222 halt=0.00 train_steps=1.00
+ep90 val_rmse=3.54229 halt=0.00 train_steps=1.00
+ep100 val_rmse=3.54700 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(3.5022244)} test={'rmse': np.float32(2.2976508)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.71051 halt=0.00 train_steps=3.00
+ep20 val_rmse=3.91339 halt=0.00 train_steps=3.00
+ep30 val_rmse=3.73800 halt=0.00 train_steps=3.00
+ep40 val_rmse=3.80182 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.99368 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.94183 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.87635 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.87881 halt=0.00 train_steps=3.00
+ep90 val_rmse=3.84911 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.87383 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rmse': np.float32(3.7380002)} test={'rmse': np.float32(2.1930819)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.95246 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.44878 halt=0.00 train_steps=1.00
+ep30 val_rmse=4.50800 halt=0.00 train_steps=1.00
+ep40 val_rmse=4.24659 halt=0.00 train_steps=1.00
+ep50 val_rmse=4.22831 halt=0.00 train_steps=1.00
+ep60 val_rmse=4.35569 halt=0.00 train_steps=1.00
+ep70 val_rmse=4.24215 halt=0.00 train_steps=1.00
+ep80 val_rmse=4.26319 halt=0.00 train_steps=1.00
+ep90 val_rmse=4.20864 halt=0.00 train_steps=1.00
+ep100 val_rmse=4.21115 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(4.208639)} test={'rmse': np.float32(2.7368205)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.94490 halt=0.00 train_steps=3.00
+ep20 val_rmse=4.65428 halt=0.00 train_steps=3.00
+ep30 val_rmse=4.29749 halt=0.00 train_steps=3.00
+ep40 val_rmse=4.12340 halt=0.00 train_steps=3.00
+ep50 val_rmse=4.25488 halt=0.00 train_steps=3.00
+ep60 val_rmse=4.06765 halt=0.00 train_steps=3.00
+ep70 val_rmse=4.09304 halt=0.00 train_steps=3.00
+ep80 val_rmse=4.01331 halt=0.00 train_steps=3.00
+ep90 val_rmse=4.00158 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.99838 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rmse': np.float32(3.998377)} test={'rmse': np.float32(2.5965567)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.07331 halt=0.00 train_steps=1.00
+ep20 val_rmse=2.53140 halt=0.00 train_steps=1.00
+ep30 val_rmse=2.55559 halt=0.00 train_steps=1.00
+ep40 val_rmse=2.62623 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.25355 halt=0.00 train_steps=1.00
+ep60 val_rmse=2.74169 halt=0.00 train_steps=1.00
+ep70 val_rmse=2.84224 halt=0.00 train_steps=1.00
+ep80 val_rmse=2.78214 halt=0.00 train_steps=1.00
+ep90 val_rmse=2.72548 halt=0.00 train_steps=1.00
+ep100 val_rmse=2.73173 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rmse': np.float32(2.5313969)} test={'rmse': np.float32(2.795284)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.21212 halt=0.00 train_steps=3.00
+ep20 val_rmse=2.99255 halt=0.00 train_steps=3.00
+ep30 val_rmse=3.08147 halt=0.00 train_steps=3.00
+ep40 val_rmse=2.91062 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.21417 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.16880 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.02580 halt=0.00 train_steps=3.00
+ep80 val_rmse=2.93491 halt=0.00 train_steps=3.00
+ep90 val_rmse=2.99295 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.01130 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(2.9106228)} test={'rmse': np.float32(3.1428812)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.42232 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.43692 halt=0.00 train_steps=1.00
+ep30 val_rmse=4.38100 halt=0.00 train_steps=1.00
+ep40 val_rmse=4.49382 halt=0.00 train_steps=1.00
+ep50 val_rmse=4.12729 halt=0.00 train_steps=1.00
+ep60 val_rmse=4.16616 halt=0.00 train_steps=1.00
+ep70 val_rmse=4.09424 halt=0.00 train_steps=1.00
+ep80 val_rmse=4.18276 halt=0.00 train_steps=1.00
+ep90 val_rmse=4.16477 halt=0.00 train_steps=1.00
+ep100 val_rmse=4.14398 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_transformer_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(4.0942407)} test={'rmse': np.float32(2.3205414)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.63800 halt=0.00 train_steps=3.00
+ep20 val_rmse=4.57586 halt=0.00 train_steps=3.00
+ep30 val_rmse=4.90990 halt=0.00 train_steps=3.00
+ep40 val_rmse=4.67940 halt=0.00 train_steps=3.00
+ep50 val_rmse=4.52739 halt=0.00 train_steps=3.00
+ep60 val_rmse=4.41796 halt=0.00 train_steps=3.00
+ep70 val_rmse=4.51618 halt=0.00 train_steps=3.00
+ep80 val_rmse=4.42805 halt=0.00 train_steps=3.00
+ep90 val_rmse=4.42820 halt=0.00 train_steps=3.00
+ep100 val_rmse=4.42252 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rmse': np.float32(4.4179597)} test={'rmse': np.float32(2.4325464)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rmse=7.08726 halt=0.00 train_steps=1.00
+ep20 val_rmse=2.42038 halt=0.00 train_steps=1.00
+ep30 val_rmse=2.47916 halt=0.00 train_steps=1.00
+ep40 val_rmse=2.36253 halt=0.00 train_steps=1.00
+ep50 val_rmse=2.72878 halt=0.00 train_steps=1.00
+ep60 val_rmse=2.68118 halt=0.00 train_steps=1.00
+ep70 val_rmse=2.76569 halt=0.00 train_steps=1.00
+ep80 val_rmse=2.72183 halt=0.00 train_steps=1.00
+ep90 val_rmse=2.67237 halt=0.00 train_steps=1.00
+ep100 val_rmse=2.63575 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_pna_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rmse': np.float32(2.3625338)} test={'rmse': np.float32(2.2610388)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rmse=6.07708 halt=0.00 train_steps=3.00
+ep20 val_rmse=3.50565 halt=0.00 train_steps=3.00
+ep30 val_rmse=3.68059 halt=0.00 train_steps=3.00
+ep40 val_rmse=3.33337 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.86831 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.85257 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.68717 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.93787 halt=0.00 train_steps=3.00
+ep90 val_rmse=3.86548 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.84458 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(3.3333704)} test={'rmse': np.float32(2.4279492)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.69543 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.55089 halt=0.00 train_steps=1.00
+ep30 val_rmse=4.35563 halt=0.00 train_steps=1.00
+ep40 val_rmse=3.99981 halt=0.00 train_steps=1.00
+ep50 val_rmse=4.18017 halt=0.00 train_steps=1.00
+ep60 val_rmse=4.07753 halt=0.00 train_steps=1.00
+ep70 val_rmse=4.06395 halt=0.00 train_steps=1.00
+ep80 val_rmse=4.04242 halt=0.00 train_steps=1.00
+ep90 val_rmse=4.02520 halt=0.00 train_steps=1.00
+ep100 val_rmse=4.02873 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_gen_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rmse': np.float32(3.9998085)} test={'rmse': np.float32(2.5587628)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=6.14156 halt=0.00 train_steps=3.00
+ep20 val_rmse=5.10186 halt=0.00 train_steps=3.00
+ep30 val_rmse=4.80566 halt=0.00 train_steps=3.00
+ep40 val_rmse=4.79767 halt=0.00 train_steps=3.00
+ep50 val_rmse=4.56064 halt=0.00 train_steps=3.00
+ep60 val_rmse=4.45480 halt=0.00 train_steps=3.00
+ep70 val_rmse=4.35459 halt=0.00 train_steps=3.00
+ep80 val_rmse=4.30087 halt=0.00 train_steps=3.00
+ep90 val_rmse=4.30667 halt=0.00 train_steps=3.00
+ep100 val_rmse=4.30497 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(4.3008733)} test={'rmse': np.float32(2.906334)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.06705 halt=0.00 train_steps=1.00
+ep20 val_rmse=3.57658 halt=0.00 train_steps=1.00
+ep30 val_rmse=3.15460 halt=0.00 train_steps=1.00
+ep40 val_rmse=3.44054 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.20349 halt=0.00 train_steps=1.00
+ep60 val_rmse=3.20162 halt=0.00 train_steps=1.00
+ep70 val_rmse=3.27482 halt=0.00 train_steps=1.00
+ep80 val_rmse=3.32754 halt=0.00 train_steps=1.00
+ep90 val_rmse=3.41237 halt=0.00 train_steps=1.00
+ep100 val_rmse=3.39052 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_film_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rmse': np.float32(3.1545956)} test={'rmse': np.float32(2.9581118)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.46774 halt=0.00 train_steps=3.00
+ep20 val_rmse=3.29521 halt=0.00 train_steps=3.00
+ep30 val_rmse=3.57690 halt=0.00 train_steps=3.00
+ep40 val_rmse=3.82412 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.59615 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.63985 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.70173 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.75424 halt=0.00 train_steps=3.00
+ep90 val_rmse=3.67384 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.68652 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rmse': np.float32(3.29521)} test={'rmse': np.float32(3.3041592)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.78635 halt=0.00 train_steps=1.00
+ep20 val_rmse=2.73636 halt=0.00 train_steps=1.00
+ep30 val_rmse=2.50124 halt=0.00 train_steps=1.00
+ep40 val_rmse=2.88505 halt=0.00 train_steps=1.00
+ep50 val_rmse=2.47723 halt=0.00 train_steps=1.00
+ep60 val_rmse=2.71000 halt=0.00 train_steps=1.00
+ep70 val_rmse=2.55505 halt=0.00 train_steps=1.00
+ep80 val_rmse=2.65575 halt=0.00 train_steps=1.00
+ep90 val_rmse=2.60532 halt=0.00 train_steps=1.00
+ep100 val_rmse=2.59153 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_resgated_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rmse': np.float32(2.4772303)} test={'rmse': np.float32(2.0041325)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.82155 halt=0.00 train_steps=3.00
+ep20 val_rmse=3.63399 halt=0.00 train_steps=3.00
+ep30 val_rmse=3.24781 halt=0.00 train_steps=3.00
+ep40 val_rmse=3.12599 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.31301 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.19715 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.09199 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.22759 halt=0.00 train_steps=3.00
+ep90 val_rmse=3.18645 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.21453 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rmse': np.float32(3.0919929)} test={'rmse': np.float32(2.0244017)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.85084 halt=0.00 train_steps=1.00
+ep20 val_rmse=2.68736 halt=0.00 train_steps=1.00
+ep30 val_rmse=2.99814 halt=0.00 train_steps=1.00
+ep40 val_rmse=2.75192 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.09092 halt=0.00 train_steps=1.00
+ep60 val_rmse=2.86459 halt=0.00 train_steps=1.00
+ep70 val_rmse=2.91348 halt=0.00 train_steps=1.00
+ep80 val_rmse=2.90389 halt=0.00 train_steps=1.00
+ep90 val_rmse=2.91836 halt=0.00 train_steps=1.00
+ep100 val_rmse=2.87933 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_tag_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rmse': np.float32(2.687361)} test={'rmse': np.float32(2.3825674)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.28550 halt=0.00 train_steps=3.00
+ep20 val_rmse=3.20135 halt=0.00 train_steps=3.00
+ep30 val_rmse=2.91026 halt=0.00 train_steps=3.00
+ep40 val_rmse=2.91577 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.09084 halt=0.00 train_steps=3.00
+ep60 val_rmse=2.92237 halt=0.00 train_steps=3.00
+ep70 val_rmse=2.73592 halt=0.00 train_steps=3.00
+ep80 val_rmse=2.80961 halt=0.00 train_steps=3.00
+ep90 val_rmse=2.85082 halt=0.00 train_steps=3.00
+ep100 val_rmse=2.81498 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rmse': np.float32(2.73592)} test={'rmse': np.float32(2.0588315)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=4.97420 halt=0.00 train_steps=1.00
+ep20 val_rmse=4.20020 halt=0.00 train_steps=1.00
+ep30 val_rmse=4.29133 halt=0.00 train_steps=1.00
+ep40 val_rmse=4.60694 halt=0.00 train_steps=1.00
+ep50 val_rmse=3.91468 halt=0.00 train_steps=1.00
+ep60 val_rmse=4.04141 halt=0.00 train_steps=1.00
+ep70 val_rmse=4.17447 halt=0.00 train_steps=1.00
+ep80 val_rmse=3.99554 halt=0.00 train_steps=1.00
+ep90 val_rmse=3.97791 halt=0.00 train_steps=1.00
+ep100 val_rmse=3.97451 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_sgc_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rmse': np.float32(3.9146762)} test={'rmse': np.float32(2.4146173)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.24142 halt=0.00 train_steps=3.00
+ep20 val_rmse=4.17618 halt=0.00 train_steps=3.00
+ep30 val_rmse=4.51520 halt=0.00 train_steps=3.00
+ep40 val_rmse=4.31196 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.92612 halt=0.00 train_steps=3.00
+ep60 val_rmse=4.11906 halt=0.00 train_steps=3.00
+ep70 val_rmse=4.22515 halt=0.00 train_steps=3.00
+ep80 val_rmse=4.09939 halt=0.00 train_steps=3.00
+ep90 val_rmse=4.09924 halt=0.00 train_steps=3.00
+ep100 val_rmse=4.07970 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rmse': np.float32(3.92612)} test={'rmse': np.float32(2.4887)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.18941 halt=0.00 train_steps=1.00
+ep20 val_rmse=3.06171 halt=0.00 train_steps=1.00
+ep30 val_rmse=3.24982 halt=0.00 train_steps=1.00
+ep40 val_rmse=2.97628 halt=0.00 train_steps=1.00
+ep50 val_rmse=2.94807 halt=0.00 train_steps=1.00
+ep60 val_rmse=3.08814 halt=0.00 train_steps=1.00
+ep70 val_rmse=3.12051 halt=0.00 train_steps=1.00
+ep80 val_rmse=3.12037 halt=0.00 train_steps=1.00
+ep90 val_rmse=3.09842 halt=0.00 train_steps=1.00
+ep100 val_rmse=3.09739 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_cheb_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rmse': np.float32(2.9480722)} test={'rmse': np.float32(2.2430642)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.33920 halt=0.00 train_steps=3.00
+ep20 val_rmse=3.46261 halt=0.00 train_steps=3.00
+ep30 val_rmse=3.31249 halt=0.00 train_steps=3.00
+ep40 val_rmse=3.05654 halt=0.00 train_steps=3.00
+ep50 val_rmse=3.01424 halt=0.00 train_steps=3.00
+ep60 val_rmse=3.15586 halt=0.00 train_steps=3.00
+ep70 val_rmse=3.12835 halt=0.00 train_steps=3.00
+ep80 val_rmse=3.13340 halt=0.00 train_steps=3.00
+ep90 val_rmse=3.15037 halt=0.00 train_steps=3.00
+ep100 val_rmse=3.13037 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rmse': np.float32(3.0142417)} test={'rmse': np.float32(2.2398787)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=6.27576 halt=0.00 train_steps=1.00
+ep20 val_rmse=6.02140 halt=0.00 train_steps=1.00
+ep30 val_rmse=4.90560 halt=0.00 train_steps=1.00
+ep40 val_rmse=4.39309 halt=0.00 train_steps=1.00
+ep50 val_rmse=4.27866 halt=0.00 train_steps=1.00
+ep60 val_rmse=4.26618 halt=0.00 train_steps=1.00
+ep70 val_rmse=4.60082 halt=0.00 train_steps=1.00
+ep80 val_rmse=4.52637 halt=0.00 train_steps=1.00
+ep90 val_rmse=4.54133 halt=0.00 train_steps=1.00
+ep100 val_rmse=4.52805 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_arma_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rmse': np.float32(4.2661796)} test={'rmse': np.float32(2.9769132)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.06825 halt=0.00 train_steps=3.00
+ep20 val_rmse=5.41479 halt=0.00 train_steps=3.00
+ep30 val_rmse=6.53946 halt=0.00 train_steps=3.00
+ep40 val_rmse=5.65785 halt=0.00 train_steps=3.00
+ep50 val_rmse=5.77324 halt=0.00 train_steps=3.00
+ep60 val_rmse=5.91626 halt=0.00 train_steps=3.00
+ep70 val_rmse=5.61429 halt=0.00 train_steps=3.00
+ep80 val_rmse=5.67131 halt=0.00 train_steps=3.00
+ep90 val_rmse=5.66869 halt=0.00 train_steps=3.00
+ep100 val_rmse=5.67086 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rmse': np.float32(5.068254)} test={'rmse': np.float32(3.6822548)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.43838 halt=0.00 train_steps=1.00
+ep20 val_rmse=2.85473 halt=0.00 train_steps=1.00
+ep30 val_rmse=2.73737 halt=0.00 train_steps=1.00
+ep40 val_rmse=2.77326 halt=0.00 train_steps=1.00
+ep50 val_rmse=2.86892 halt=0.00 train_steps=1.00
+ep60 val_rmse=2.84167 halt=0.00 train_steps=1.00
+ep70 val_rmse=2.98379 halt=0.00 train_steps=1.00
+ep80 val_rmse=2.91592 halt=0.00 train_steps=1.00
+ep90 val_rmse=2.85642 halt=0.00 train_steps=1.00
+ep100 val_rmse=2.90593 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_mf_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rmse': np.float32(2.7373676)} test={'rmse': np.float32(2.8884995)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=3.35105 halt=0.00 train_steps=3.00
+ep20 val_rmse=2.80208 halt=0.00 train_steps=3.00
+ep30 val_rmse=2.63276 halt=0.00 train_steps=3.00
+ep40 val_rmse=2.50604 halt=0.00 train_steps=3.00
+ep50 val_rmse=2.86816 halt=0.00 train_steps=3.00
+ep60 val_rmse=2.64704 halt=0.00 train_steps=3.00
+ep70 val_rmse=2.82985 halt=0.00 train_steps=3.00
+ep80 val_rmse=2.78860 halt=0.00 train_steps=3.00
+ep90 val_rmse=2.79351 halt=0.00 train_steps=3.00
+ep100 val_rmse=2.79727 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(2.5060387)} test={'rmse': np.float32(3.1891541)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molfreesolv view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=6.04619 halt=0.00 train_steps=1.00
+ep20 val_rmse=10.89709 halt=0.00 train_steps=1.00
+ep30 val_rmse=10.14273 halt=0.00 train_steps=1.00
+ep40 val_rmse=10.99318 halt=0.00 train_steps=1.00
+ep50 val_rmse=9.67413 halt=0.00 train_steps=1.00
+ep60 val_rmse=9.13696 halt=0.00 train_steps=1.00
+ep70 val_rmse=9.46892 halt=0.00 train_steps=1.00
+ep80 val_rmse=9.52322 halt=0.00 train_steps=1.00
+ep90 val_rmse=9.60440 halt=0.00 train_steps=1.00
+ep100 val_rmse=9.61254 halt=0.00 train_steps=1.00
+[ogbg-molfreesolv_appnp_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rmse': np.float32(6.0461874)} test={'rmse': np.float32(4.647762)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molfreesolv view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molfreesolv --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=5.55929 halt=0.00 train_steps=3.00
+ep20 val_rmse=9.63447 halt=0.00 train_steps=3.00
+ep30 val_rmse=7.79098 halt=0.00 train_steps=3.00
+ep40 val_rmse=8.98404 halt=0.00 train_steps=3.00
+ep50 val_rmse=6.08084 halt=0.00 train_steps=3.00
+ep60 val_rmse=9.37069 halt=0.00 train_steps=3.00
+ep70 val_rmse=7.20140 halt=0.00 train_steps=3.00
+ep80 val_rmse=8.13046 halt=0.00 train_steps=3.00
+ep90 val_rmse=7.07030 halt=0.00 train_steps=3.00
+ep100 val_rmse=6.67070 halt=0.00 train_steps=3.00
+[ogbg-molfreesolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rmse': np.float32(5.5592947)} test={'rmse': np.float32(3.6549187)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molfreesolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molfreesolv | appnp | rmse | 1 | 6.0462 +/- 0.0000 | 4.6478 +/- 0.0000 |
+| ogbg-molfreesolv | arma | rmse | 1 | 4.2662 +/- 0.0000 | 2.9769 +/- 0.0000 |
+| ogbg-molfreesolv | cheb | rmse | 1 | 2.9481 +/- 0.0000 | 2.2431 +/- 0.0000 |
+| ogbg-molfreesolv | film | rmse | 1 | 3.1546 +/- 0.0000 | 2.9581 +/- 0.0000 |
+| ogbg-molfreesolv | gatv2 | rmse | 1 | 4.2086 +/- 0.0000 | 2.7368 +/- 0.0000 |
+| ogbg-molfreesolv | gcn | rmse | 1 | 3.7172 +/- 0.0000 | 2.4851 +/- 0.0000 |
+| ogbg-molfreesolv | gen | rmse | 1 | 3.9998 +/- 0.0000 | 2.5588 +/- 0.0000 |
+| ogbg-molfreesolv | gin | rmse | 1 | 4.0190 +/- 0.0000 | 3.4898 +/- 0.0000 |
+| ogbg-molfreesolv | gine | rmse | 1 | 3.2961 +/- 0.0000 | 3.1442 +/- 0.0000 |
+| ogbg-molfreesolv | graphconv | rmse | 1 | 2.5314 +/- 0.0000 | 2.7953 +/- 0.0000 |
+| ogbg-molfreesolv | graphsage | rmse | 1 | 3.5022 +/- 0.0000 | 2.2977 +/- 0.0000 |
+| ogbg-molfreesolv | mf | rmse | 1 | 2.7374 +/- 0.0000 | 2.8885 +/- 0.0000 |
+| ogbg-molfreesolv | pna | rmse | 1 | 2.3625 +/- 0.0000 | 2.2610 +/- 0.0000 |
+| ogbg-molfreesolv | resgated | rmse | 1 | 2.4772 +/- 0.0000 | 2.0041 +/- 0.0000 |
+| ogbg-molfreesolv | sgc | rmse | 1 | 3.9147 +/- 0.0000 | 2.4146 +/- 0.0000 |
+| ogbg-molfreesolv | tag | rmse | 1 | 2.6874 +/- 0.0000 | 2.3826 +/- 0.0000 |
+| ogbg-molfreesolv | transformer | rmse | 1 | 4.0942 +/- 0.0000 | 2.3205 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molfreesolv | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 5.5593 (0.4869) | 3.6549 (0.9928) |  |
+| ogbg-molfreesolv | arma | fixed-rrog-T1-ns3 | rmse | 1 | 5.0683 (-0.8021) | 3.6823 (-0.7053) |  |
+| ogbg-molfreesolv | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 3.0142 (-0.0662) | 2.2399 (0.0032) |  |
+| ogbg-molfreesolv | film | fixed-rrog-T1-ns3 | rmse | 1 | 3.2952 (-0.1406) | 3.3042 (-0.3460) |  |
+| ogbg-molfreesolv | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 3.9984 (0.2103) | 2.5966 (0.1403) |  |
+| ogbg-molfreesolv | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 3.5888 (0.1285) | 2.4444 (0.0407) |  |
+| ogbg-molfreesolv | gen | fixed-rrog-T1-ns3 | rmse | 1 | 4.3009 (-0.3011) | 2.9063 (-0.3476) |  |
+| ogbg-molfreesolv | gin | fixed-rrog-T1-ns3 | rmse | 1 | 3.9743 (0.0447) | 3.4292 (0.0607) |  |
+| ogbg-molfreesolv | gine | fixed-rrog-T1-ns3 | rmse | 1 | 4.4468 (-1.1508) | 3.7405 (-0.5963) |  |
+| ogbg-molfreesolv | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 2.9106 (-0.3792) | 3.1429 (-0.3476) |  |
+| ogbg-molfreesolv | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 3.7380 (-0.2358) | 2.1931 (0.1046) |  |
+| ogbg-molfreesolv | mf | fixed-rrog-T1-ns3 | rmse | 1 | 2.5060 (0.2313) | 3.1892 (-0.3007) |  |
+| ogbg-molfreesolv | pna | fixed-rrog-T1-ns3 | rmse | 1 | 3.3334 (-0.9708) | 2.4279 (-0.1669) |  |
+| ogbg-molfreesolv | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 3.0920 (-0.6148) | 2.0244 (-0.0203) |  |
+| ogbg-molfreesolv | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 3.9261 (-0.0114) | 2.4887 (-0.0741) |  |
+| ogbg-molfreesolv | tag | fixed-rrog-T1-ns3 | rmse | 1 | 2.7359 (-0.0486) | 2.0588 (0.3237) |  |
+| ogbg-molfreesolv | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 4.4180 (-0.3237) | 2.4325 (-0.1120) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8251 (0.0330) | 0.7725 (-0.0117) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7740 (0.0210) | 0.7590 (0.0276) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7923 (-0.0221) | 0.7227 (-0.0015) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7659 (0.0181) | 0.7136 (0.0117) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7717 (0.0189) | 0.7181 (-0.0074) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-molhiv_T1_ns3_s0.log b/logs/ogbg-molhiv_T1_ns3_s0.log
new file mode 100644
index 0000000..a4dc30e
--- /dev/null
+++ b/logs/ogbg-molhiv_T1_ns3_s0.log
@@ -0,0 +1,626 @@
+[skip] runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=gin compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.52613 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.70545 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.65789 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77100 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75591 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74447 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75031 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73179 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.74630 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74027 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.7710048010973936} test={'rocauc': 0.7667761061434172} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=gine compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.60417 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.71514 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.71708 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.73860 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.73481 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73761 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.72236 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.74896 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.74260 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74183 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.7489589457182049} test={'rocauc': 0.7375634909905561} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.64381 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76352 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75232 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77157 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.72431 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.78334 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76257 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75355 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76158 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75779 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.783344356261023} test={'rocauc': 0.7447787713165569} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.67776 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74009 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.69741 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77888 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78935 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76325 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75591 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.72551 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.71822 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.71852 halt=0.00 train_steps=3.00
+[ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7893457280031354} test={'rocauc': 0.7632959307827497} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.64010 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76351 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.80490 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75482 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78361 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.78926 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75524 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77222 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76119 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76813 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.8049003037428963} test={'rocauc': 0.7485679522586377} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.68284 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75036 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.73015 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.78168 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77547 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75932 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77169 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76077 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75885 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75807 halt=0.00 train_steps=3.00
+[ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.7816847932588673} test={'rocauc': 0.7492632148168176} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.71048 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.73061 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.78382 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76229 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78076 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77954 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76771 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76045 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75987 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76094 halt=0.00 train_steps=3.00
+[ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7838158926121889} test={'rocauc': 0.7647501883002762} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=pna compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.73911 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.65293 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.76153 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.73555 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.72598 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.80966 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.76538 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.77175 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.76773 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.76248 halt=0.00 train_steps=3.00
+[ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.8096554722712129} test={'rocauc': 0.7601633867011722} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=gen compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.73991 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75281 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.66395 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75387 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77401 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77070 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73017 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.72701 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73952 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.73520 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.77400548696845} test={'rocauc': 0.7589563336487767} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=film compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.66456 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.77269 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77029 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.82515 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71021 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.80563 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78091 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76824 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77147 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75765 halt=0.00 train_steps=3.00
+[ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.8251457475994514} test={'rocauc': 0.7725487166611946} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.72860 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.72892 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76794 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.78591 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.79226 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76919 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78373 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.78924 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.78751 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.78266 halt=0.00 train_steps=3.00
+[ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7922576180678031} test={'rocauc': 0.7226559029722475} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=tag compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.59326 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69148 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.65895 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.65750 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76568 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75549 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76344 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76911 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77170 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76987 halt=0.00 train_steps=3.00
+[ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rocauc': 0.7717029198510681} test={'rocauc': 0.7181154522103554} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.70493 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.73664 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.72784 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75185 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.72864 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75657 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76280 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76591 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75411 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75739 halt=0.00 train_steps=3.00
+[ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.7659097589653145} test={'rocauc': 0.7135769327333474} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.75264 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76719 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74289 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.79468 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76474 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76252 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76949 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75856 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75231 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75098 halt=0.00 train_steps=3.00
+[ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.794682662159514} test={'rocauc': 0.7290194866644778} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=arma compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.68967 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.73124 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74889 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77770 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77862 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.79564 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76844 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76816 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77160 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76284 halt=0.00 train_steps=3.00
+[ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.7956441064079952} test={'rocauc': 0.6966917089939937} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=mf compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.68258 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74430 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75018 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76723 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77540 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74952 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75421 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75108 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75275 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75041 halt=0.00 train_steps=3.00
+[ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7754017244757985} test={'rocauc': 0.7114583132157826} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[skip] runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molhiv view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:0
+ep10 val_rocauc=0.71241 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69902 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75349 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.70339 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.74383 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75732 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.72123 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.71581 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.71400 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.71511 halt=0.00 train_steps=3.00
+[ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.7573179992161474} test={'rocauc': 0.7228548253152822} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molfreesolv | appnp | rmse | 1 | 6.0462 +/- 0.0000 | 4.6478 +/- 0.0000 |
+| ogbg-molfreesolv | arma | rmse | 1 | 4.2662 +/- 0.0000 | 2.9769 +/- 0.0000 |
+| ogbg-molfreesolv | cheb | rmse | 1 | 2.9481 +/- 0.0000 | 2.2431 +/- 0.0000 |
+| ogbg-molfreesolv | film | rmse | 1 | 3.1546 +/- 0.0000 | 2.9581 +/- 0.0000 |
+| ogbg-molfreesolv | gatv2 | rmse | 1 | 4.2086 +/- 0.0000 | 2.7368 +/- 0.0000 |
+| ogbg-molfreesolv | gcn | rmse | 1 | 3.7172 +/- 0.0000 | 2.4851 +/- 0.0000 |
+| ogbg-molfreesolv | gen | rmse | 1 | 3.9998 +/- 0.0000 | 2.5588 +/- 0.0000 |
+| ogbg-molfreesolv | gin | rmse | 1 | 4.0190 +/- 0.0000 | 3.4898 +/- 0.0000 |
+| ogbg-molfreesolv | gine | rmse | 1 | 3.2961 +/- 0.0000 | 3.1442 +/- 0.0000 |
+| ogbg-molfreesolv | graphconv | rmse | 1 | 2.5314 +/- 0.0000 | 2.7953 +/- 0.0000 |
+| ogbg-molfreesolv | graphsage | rmse | 1 | 3.5022 +/- 0.0000 | 2.2977 +/- 0.0000 |
+| ogbg-molfreesolv | mf | rmse | 1 | 2.7374 +/- 0.0000 | 2.8885 +/- 0.0000 |
+| ogbg-molfreesolv | pna | rmse | 1 | 2.3625 +/- 0.0000 | 2.2610 +/- 0.0000 |
+| ogbg-molfreesolv | resgated | rmse | 1 | 2.4772 +/- 0.0000 | 2.0041 +/- 0.0000 |
+| ogbg-molfreesolv | sgc | rmse | 1 | 3.9147 +/- 0.0000 | 2.4146 +/- 0.0000 |
+| ogbg-molfreesolv | tag | rmse | 1 | 2.6874 +/- 0.0000 | 2.3826 +/- 0.0000 |
+| ogbg-molfreesolv | transformer | rmse | 1 | 4.0942 +/- 0.0000 | 2.3205 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-mollipo | appnp | rmse | 1 | 0.9015 +/- 0.0000 | 0.9070 +/- 0.0000 |
+| ogbg-mollipo | arma | rmse | 1 | 0.7325 +/- 0.0000 | 0.7295 +/- 0.0000 |
+| ogbg-mollipo | cheb | rmse | 1 | 0.7188 +/- 0.0000 | 0.7180 +/- 0.0000 |
+| ogbg-mollipo | film | rmse | 1 | 0.7620 +/- 0.0000 | 0.7371 +/- 0.0000 |
+| ogbg-mollipo | gatv2 | rmse | 1 | 0.6865 +/- 0.0000 | 0.7308 +/- 0.0000 |
+| ogbg-mollipo | gcn | rmse | 1 | 0.7379 +/- 0.0000 | 0.7828 +/- 0.0000 |
+| ogbg-mollipo | gen | rmse | 1 | 0.7046 +/- 0.0000 | 0.7379 +/- 0.0000 |
+| ogbg-mollipo | gin | rmse | 1 | 0.6854 +/- 0.0000 | 0.7390 +/- 0.0000 |
+| ogbg-mollipo | gine | rmse | 1 | 0.6615 +/- 0.0000 | 0.7341 +/- 0.0000 |
+| ogbg-mollipo | graphconv | rmse | 1 | 0.7178 +/- 0.0000 | 0.7297 +/- 0.0000 |
+| ogbg-mollipo | graphsage | rmse | 1 | 0.7239 +/- 0.0000 | 0.7783 +/- 0.0000 |
+| ogbg-mollipo | mf | rmse | 1 | 0.7129 +/- 0.0000 | 0.7405 +/- 0.0000 |
+| ogbg-mollipo | pna | rmse | 1 | 0.7179 +/- 0.0000 | 0.7749 +/- 0.0000 |
+| ogbg-mollipo | resgated | rmse | 1 | 0.6721 +/- 0.0000 | 0.7270 +/- 0.0000 |
+| ogbg-mollipo | sgc | rmse | 1 | 0.7505 +/- 0.0000 | 0.8176 +/- 0.0000 |
+| ogbg-mollipo | tag | rmse | 1 | 0.6692 +/- 0.0000 | 0.7227 +/- 0.0000 |
+| ogbg-mollipo | transformer | rmse | 1 | 0.6810 +/- 0.0000 | 0.7346 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molfreesolv | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 5.5593 (0.4869) | 3.6549 (0.9928) |  |
+| ogbg-molfreesolv | arma | fixed-rrog-T1-ns3 | rmse | 1 | 5.0683 (-0.8021) | 3.6823 (-0.7053) |  |
+| ogbg-molfreesolv | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 3.0142 (-0.0662) | 2.2399 (0.0032) |  |
+| ogbg-molfreesolv | film | fixed-rrog-T1-ns3 | rmse | 1 | 3.2952 (-0.1406) | 3.3042 (-0.3460) |  |
+| ogbg-molfreesolv | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 3.9984 (0.2103) | 2.5966 (0.1403) |  |
+| ogbg-molfreesolv | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 3.5888 (0.1285) | 2.4444 (0.0407) |  |
+| ogbg-molfreesolv | gen | fixed-rrog-T1-ns3 | rmse | 1 | 4.3009 (-0.3011) | 2.9063 (-0.3476) |  |
+| ogbg-molfreesolv | gin | fixed-rrog-T1-ns3 | rmse | 1 | 3.9743 (0.0447) | 3.4292 (0.0607) |  |
+| ogbg-molfreesolv | gine | fixed-rrog-T1-ns3 | rmse | 1 | 4.4468 (-1.1508) | 3.7405 (-0.5963) |  |
+| ogbg-molfreesolv | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 2.9106 (-0.3792) | 3.1429 (-0.3476) |  |
+| ogbg-molfreesolv | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 3.7380 (-0.2358) | 2.1931 (0.1046) |  |
+| ogbg-molfreesolv | mf | fixed-rrog-T1-ns3 | rmse | 1 | 2.5060 (0.2313) | 3.1892 (-0.3007) |  |
+| ogbg-molfreesolv | pna | fixed-rrog-T1-ns3 | rmse | 1 | 3.3334 (-0.9708) | 2.4279 (-0.1669) |  |
+| ogbg-molfreesolv | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 3.0920 (-0.6148) | 2.0244 (-0.0203) |  |
+| ogbg-molfreesolv | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 3.9261 (-0.0114) | 2.4887 (-0.0741) |  |
+| ogbg-molfreesolv | tag | fixed-rrog-T1-ns3 | rmse | 1 | 2.7359 (-0.0486) | 2.0588 (0.3237) |  |
+| ogbg-molfreesolv | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 4.4180 (-0.3237) | 2.4325 (-0.1120) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7573 (-0.0102) | 0.7229 (0.0229) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7956 (0.0084) | 0.6967 (-0.0329) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7947 (0.0116) | 0.7290 (0.0008) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8251 (0.0330) | 0.7725 (-0.0117) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7740 (0.0210) | 0.7590 (0.0276) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7754 (-0.0091) | 0.7115 (0.0041) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7923 (-0.0221) | 0.7227 (-0.0015) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7659 (0.0181) | 0.7136 (0.0117) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7717 (0.0189) | 0.7181 (-0.0074) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-mollipo | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 0.8393 (0.0622) | 0.9174 (-0.0104) |  |
+| ogbg-mollipo | arma | fixed-rrog-T1-ns3 | rmse | 1 | 0.7173 (0.0152) | 0.7548 (-0.0253) |  |
+| ogbg-mollipo | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.6990 (0.0198) | 0.7132 (0.0048) |  |
+| ogbg-mollipo | film | fixed-rrog-T1-ns3 | rmse | 1 | 0.8122 (-0.0502) | 0.7353 (0.0018) |  |
+| ogbg-mollipo | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 0.7080 (-0.0215) | 0.7334 (-0.0026) |  |
+| ogbg-mollipo | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.7730 (-0.0351) | 0.7759 (0.0069) |  |
+| ogbg-mollipo | gen | fixed-rrog-T1-ns3 | rmse | 1 | 0.6594 (0.0452) | 0.7456 (-0.0077) |  |
+| ogbg-mollipo | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.6749 (0.0105) | 0.7073 (0.0317) |  |
+| ogbg-mollipo | gine | fixed-rrog-T1-ns3 | rmse | 1 | 0.7168 (-0.0553) | 0.7316 (0.0025) |  |
+| ogbg-mollipo | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 0.7372 (-0.0195) | 0.7396 (-0.0099) |  |
+| ogbg-mollipo | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.7184 (0.0055) | 0.7720 (0.0063) |  |
+| ogbg-mollipo | mf | fixed-rrog-T1-ns3 | rmse | 1 | 0.7050 (0.0080) | 0.7101 (0.0304) |  |
+| ogbg-mollipo | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.7466 (-0.0287) | 0.7908 (-0.0159) |  |
+| ogbg-mollipo | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.6766 (-0.0046) | 0.7144 (0.0126) |  |
+| ogbg-mollipo | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 0.7537 (-0.0032) | 0.7490 (0.0685) |  |
+| ogbg-mollipo | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.6743 (-0.0052) | 0.7201 (0.0026) |  |
+| ogbg-mollipo | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.6688 (0.0121) | 0.7396 (-0.0050) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-molhiv_T1_ns3_s1.log b/logs/ogbg-molhiv_T1_ns3_s1.log
new file mode 100644
index 0000000..7219078
--- /dev/null
+++ b/logs/ogbg-molhiv_T1_ns3_s1.log
@@ -0,0 +1,887 @@
+[run] ogbg-molhiv view=gin compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.67381 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.73250 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.78519 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77910 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.78799 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76695 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76847 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.78886 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.78626 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.78340 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s1] best_ep=80 val={'rocauc': 0.7888619439545366} test={'rocauc': 0.7680604105911663} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=gin compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.69850 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74071 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.69786 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75877 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71941 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75137 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78576 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.78905 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.79003 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.78834 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=90 val={'rocauc': 0.7900285371350186} test={'rocauc': 0.7325170435890999} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=gine compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.64062 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.69908 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.73367 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76310 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.73530 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76138 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.73755 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.73645 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.73763 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.72804 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.763098912404468} test={'rocauc': 0.7342204368566407} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=gine compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.70912 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.67273 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.72222 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.73406 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71632 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73716 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75690 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75768 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.74671 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75744 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=80 val={'rocauc': 0.7576823682147755} test={'rocauc': 0.7671121497132043} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=gcn compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.65329 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76273 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76982 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77496 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.73880 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76063 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76303 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75600 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75729 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75968 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.774963869292573} test={'rocauc': 0.7313544100890322} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.62065 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76118 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.78244 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75010 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.79120 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77060 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77926 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76151 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76069 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75905 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=50 val={'rocauc': 0.7912043160885752} test={'rocauc': 0.7217501303617297} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=graphsage compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.73273 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.78605 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77469 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77753 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77763 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77741 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77440 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.78128 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77955 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77872 halt=0.00 train_steps=1.00
+[ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s1] best_ep=20 val={'rocauc': 0.7860541593180482} test={'rocauc': 0.7280480503679099} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.68881 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.78881 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76629 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77119 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76368 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75186 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76720 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75454 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75202 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74874 halt=0.00 train_steps=3.00
+[ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=20 val={'rocauc': 0.7888068293160886} test={'rocauc': 0.709044207110991} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=gatv2 compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.70967 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.77066 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.75373 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76225 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77558 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75771 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75023 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75254 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75438 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75340 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s1] best_ep=50 val={'rocauc': 0.7755777851263962} test={'rocauc': 0.7039629965816258} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.66289 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.68912 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.71125 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.71398 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71899 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.72711 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73926 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73382 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73295 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.72817 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=70 val={'rocauc': 0.7392587693513621} test={'rocauc': 0.7076787886981208} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=graphconv compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.73045 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.79112 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.78046 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.78181 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75365 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77726 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77815 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.78157 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.78202 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.78072 halt=0.00 train_steps=1.00
+[ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s1] best_ep=20 val={'rocauc': 0.7911185822065452} test={'rocauc': 0.7552501979567006} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.71173 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.77306 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76716 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77208 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75010 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75761 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.74435 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77844 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75856 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75935 halt=0.00 train_steps=3.00
+[ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=80 val={'rocauc': 0.7784422153635117} test={'rocauc': 0.7098244462040595} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=transformer compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.75635 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.72700 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77672 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76402 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76397 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76276 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76204 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.73632 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74906 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74765 halt=0.00 train_steps=1.00
+[ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s1] best_ep=30 val={'rocauc': 0.7767152900254751} test={'rocauc': 0.7883891152783947} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.74469 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.72637 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76420 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76498 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.73394 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75693 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76513 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73841 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73758 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.73136 halt=0.00 train_steps=3.00
+[ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=70 val={'rocauc': 0.7651320301783265} test={'rocauc': 0.749757623747079} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=pna compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.71222 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.77237 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.79382 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.79831 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.78984 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.79521 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.77282 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.77904 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.77221 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.77298 halt=0.00 train_steps=1.00
+[ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.7983079805996471} test={'rocauc': 0.7485834025377083} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=pna compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.66012 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.74263 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.68730 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.76946 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.78428 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.80766 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.85103 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.82721 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.80115 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.81327 halt=0.00 train_steps=3.00
+[ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=70 val={'rocauc': 0.8510281941994904} test={'rocauc': 0.7524633538693293} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=gen compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.70215 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.70943 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.72126 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.74237 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75415 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77710 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77079 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77663 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77879 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77747 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s1] best_ep=90 val={'rocauc': 0.7787851508916324} test={'rocauc': 0.7435079858629947} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=gen compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.64967 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.70673 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75758 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.73586 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.72948 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73563 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73531 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73478 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73802 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.73543 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=30 val={'rocauc': 0.7575843866353126} test={'rocauc': 0.7301454257517527} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=film compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.70298 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.73054 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.72688 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.73843 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.71422 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.71582 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.68800 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.70108 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.69239 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.69946 halt=0.00 train_steps=1.00
+[ogbg-molhiv_film_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.7384259259259259} test={'rocauc': 0.7277853956237085} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=film compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.57982 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76051 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75530 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74002 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.73811 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76883 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77568 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77672 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76181 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76335 halt=0.00 train_steps=3.00
+[ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=80 val={'rocauc': 0.7767214138741916} test={'rocauc': 0.721711504664053} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=resgated compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.72395 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76516 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.75055 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.78604 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.78080 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77578 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76166 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77023 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75281 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74789 halt=0.00 train_steps=1.00
+[ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.7860449735449736} test={'rocauc': 0.715921512582321} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.72839 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75459 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.72771 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.78256 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.81516 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75649 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77860 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76988 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77731 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.77520 halt=0.00 train_steps=3.00
+[ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=50 val={'rocauc': 0.8151638741916519} test={'rocauc': 0.7581278124336122} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=tag compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.58770 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.68145 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.72067 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.73392 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.70822 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.71426 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.70873 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.72983 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.72147 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.71378 halt=0.00 train_steps=1.00
+[ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.7339157113462669} test={'rocauc': 0.7487765310260917} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=tag compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.55144 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.60799 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.70607 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.69128 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.72045 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74126 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.72293 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.71634 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.71546 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.72607 halt=0.00 train_steps=3.00
+[ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=60 val={'rocauc': 0.7412612678816383} test={'rocauc': 0.7289634794028468} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=sgc compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.72619 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.73283 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76917 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.75675 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76761 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76763 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75765 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75903 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75424 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75210 halt=0.00 train_steps=1.00
+[ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s1] best_ep=30 val={'rocauc': 0.7691676464824613} test={'rocauc': 0.7100407501110487} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.66342 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.66210 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74188 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.68794 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76040 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74793 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73677 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75024 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.74898 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74779 halt=0.00 train_steps=3.00
+[ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=50 val={'rocauc': 0.7603952331961592} test={'rocauc': 0.675208095946233} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=cheb compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.70465 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.74216 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.73979 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.75779 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.73594 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.73526 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75417 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.73860 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74738 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74227 halt=0.00 train_steps=1.00
+[ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s1] best_ep=40 val={'rocauc': 0.7577895355673133} test={'rocauc': 0.7291006006295989} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.66118 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.68799 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.73086 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76554 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.74577 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75891 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73923 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75111 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75026 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74760 halt=0.00 train_steps=3.00
+[ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=40 val={'rocauc': 0.7655423280423279} test={'rocauc': 0.7438594797118523} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=arma compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.71067 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.74686 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.73423 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76570 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77661 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.73695 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77359 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76691 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77045 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77618 halt=0.00 train_steps=1.00
+[ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s1] best_ep=50 val={'rocauc': 0.7766081226729374} test={'rocauc': 0.7197338689430077} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=arma compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.67783 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69752 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.73554 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.73143 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75276 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75716 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75640 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75654 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75214 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75103 halt=0.00 train_steps=3.00
+[ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=60 val={'rocauc': 0.7571649029982364} test={'rocauc': 0.6928774213484231} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=mf compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.74885 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.65990 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.73615 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.75659 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75728 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.73114 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.73473 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.72317 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.72240 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.72247 halt=0.00 train_steps=1.00
+[ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1] best_ep=50 val={'rocauc': 0.757284318048207} test={'rocauc': 0.7282353850016416} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=mf compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.77872 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76027 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76594 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.79620 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77028 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.78464 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77227 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77065 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.74908 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74528 halt=0.00 train_steps=3.00
+[ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=40 val={'rocauc': 0.796195252792475} test={'rocauc': 0.7153228142683327} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1.json
+[run] ogbg-molhiv view=appnp compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.67801 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.69347 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.68345 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.69070 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.64639 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.62556 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.62621 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.62966 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.63021 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.62319 halt=0.00 train_steps=1.00
+[ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s1] best_ep=20 val={'rocauc': 0.6934707524985303} test={'rocauc': 0.7044149172444427} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s1.json
+[run] ogbg-molhiv view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 1 --device cuda:0
+ep10 val_rocauc=0.68888 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74622 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.69872 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.70360 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71557 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75122 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73754 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.74075 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73340 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.73030 halt=0.00 train_steps=3.00
+[ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1] best_ep=60 val={'rocauc': 0.75122170781893} test={'rocauc': 0.7448212595840012} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molfreesolv | appnp | rmse | 1 | 6.0462 +/- 0.0000 | 4.6478 +/- 0.0000 |
+| ogbg-molfreesolv | arma | rmse | 1 | 4.2662 +/- 0.0000 | 2.9769 +/- 0.0000 |
+| ogbg-molfreesolv | cheb | rmse | 1 | 2.9481 +/- 0.0000 | 2.2431 +/- 0.0000 |
+| ogbg-molfreesolv | film | rmse | 1 | 3.1546 +/- 0.0000 | 2.9581 +/- 0.0000 |
+| ogbg-molfreesolv | gatv2 | rmse | 1 | 4.2086 +/- 0.0000 | 2.7368 +/- 0.0000 |
+| ogbg-molfreesolv | gcn | rmse | 1 | 3.7172 +/- 0.0000 | 2.4851 +/- 0.0000 |
+| ogbg-molfreesolv | gen | rmse | 1 | 3.9998 +/- 0.0000 | 2.5588 +/- 0.0000 |
+| ogbg-molfreesolv | gin | rmse | 1 | 4.0190 +/- 0.0000 | 3.4898 +/- 0.0000 |
+| ogbg-molfreesolv | gine | rmse | 1 | 3.2961 +/- 0.0000 | 3.1442 +/- 0.0000 |
+| ogbg-molfreesolv | graphconv | rmse | 1 | 2.5314 +/- 0.0000 | 2.7953 +/- 0.0000 |
+| ogbg-molfreesolv | graphsage | rmse | 1 | 3.5022 +/- 0.0000 | 2.2977 +/- 0.0000 |
+| ogbg-molfreesolv | mf | rmse | 1 | 2.7374 +/- 0.0000 | 2.8885 +/- 0.0000 |
+| ogbg-molfreesolv | pna | rmse | 1 | 2.3625 +/- 0.0000 | 2.2610 +/- 0.0000 |
+| ogbg-molfreesolv | resgated | rmse | 1 | 2.4772 +/- 0.0000 | 2.0041 +/- 0.0000 |
+| ogbg-molfreesolv | sgc | rmse | 1 | 3.9147 +/- 0.0000 | 2.4146 +/- 0.0000 |
+| ogbg-molfreesolv | tag | rmse | 1 | 2.6874 +/- 0.0000 | 2.3826 +/- 0.0000 |
+| ogbg-molfreesolv | transformer | rmse | 1 | 4.0942 +/- 0.0000 | 2.3205 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 2 | 0.7305 +/- 0.0523 | 0.7022 +/- 0.0031 |
+| ogbg-molhiv | arma | rocauc | 2 | 0.7819 +/- 0.0075 | 0.7247 +/- 0.0070 |
+| ogbg-molhiv | cheb | rocauc | 2 | 0.7705 +/- 0.0179 | 0.7286 +/- 0.0007 |
+| ogbg-molhiv | film | rocauc | 2 | 0.7653 +/- 0.0380 | 0.7560 +/- 0.0399 |
+| ogbg-molhiv | gatv2 | rocauc | 2 | 0.7795 +/- 0.0056 | 0.7301 +/- 0.0370 |
+| ogbg-molhiv | gcn | rocauc | 2 | 0.7752 +/- 0.0003 | 0.7256 +/- 0.0082 |
+| ogbg-molhiv | gen | rocauc | 2 | 0.7659 +/- 0.0182 | 0.7374 +/- 0.0086 |
+| ogbg-molhiv | gin | rocauc | 2 | 0.8028 +/- 0.0197 | 0.7702 +/- 0.0031 |
+| ogbg-molhiv | gine | rocauc | 2 | 0.7787 +/- 0.0220 | 0.7394 +/- 0.0073 |
+| ogbg-molhiv | graphconv | rocauc | 2 | 0.7809 +/- 0.0145 | 0.7330 +/- 0.0314 |
+| ogbg-molhiv | graphsage | rocauc | 2 | 0.7915 +/- 0.0076 | 0.7453 +/- 0.0244 |
+| ogbg-molhiv | mf | rocauc | 2 | 0.7709 +/- 0.0193 | 0.7178 +/- 0.0148 |
+| ogbg-molhiv | pna | rocauc | 2 | 0.7881 +/- 0.0144 | 0.7567 +/- 0.0115 |
+| ogbg-molhiv | resgated | rocauc | 2 | 0.8002 +/- 0.0200 | 0.7200 +/- 0.0058 |
+| ogbg-molhiv | sgc | rocauc | 2 | 0.7585 +/- 0.0151 | 0.7060 +/- 0.0057 |
+| ogbg-molhiv | tag | rocauc | 2 | 0.7434 +/- 0.0134 | 0.7372 +/- 0.0164 |
+| ogbg-molhiv | transformer | rocauc | 2 | 0.7692 +/- 0.0106 | 0.7716 +/- 0.0238 |
+| ogbg-mollipo | appnp | rmse | 1 | 0.9015 +/- 0.0000 | 0.9070 +/- 0.0000 |
+| ogbg-mollipo | arma | rmse | 1 | 0.7325 +/- 0.0000 | 0.7295 +/- 0.0000 |
+| ogbg-mollipo | cheb | rmse | 1 | 0.7188 +/- 0.0000 | 0.7180 +/- 0.0000 |
+| ogbg-mollipo | film | rmse | 1 | 0.7620 +/- 0.0000 | 0.7371 +/- 0.0000 |
+| ogbg-mollipo | gatv2 | rmse | 1 | 0.6865 +/- 0.0000 | 0.7308 +/- 0.0000 |
+| ogbg-mollipo | gcn | rmse | 1 | 0.7379 +/- 0.0000 | 0.7828 +/- 0.0000 |
+| ogbg-mollipo | gen | rmse | 1 | 0.7046 +/- 0.0000 | 0.7379 +/- 0.0000 |
+| ogbg-mollipo | gin | rmse | 1 | 0.6854 +/- 0.0000 | 0.7390 +/- 0.0000 |
+| ogbg-mollipo | gine | rmse | 1 | 0.6615 +/- 0.0000 | 0.7341 +/- 0.0000 |
+| ogbg-mollipo | graphconv | rmse | 1 | 0.7178 +/- 0.0000 | 0.7297 +/- 0.0000 |
+| ogbg-mollipo | graphsage | rmse | 1 | 0.7239 +/- 0.0000 | 0.7783 +/- 0.0000 |
+| ogbg-mollipo | mf | rmse | 1 | 0.7129 +/- 0.0000 | 0.7405 +/- 0.0000 |
+| ogbg-mollipo | pna | rmse | 1 | 0.7179 +/- 0.0000 | 0.7749 +/- 0.0000 |
+| ogbg-mollipo | resgated | rmse | 1 | 0.6721 +/- 0.0000 | 0.7270 +/- 0.0000 |
+| ogbg-mollipo | sgc | rmse | 1 | 0.7505 +/- 0.0000 | 0.8176 +/- 0.0000 |
+| ogbg-mollipo | tag | rmse | 1 | 0.6692 +/- 0.0000 | 0.7227 +/- 0.0000 |
+| ogbg-mollipo | transformer | rmse | 1 | 0.6810 +/- 0.0000 | 0.7346 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molfreesolv | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 5.5593 (0.4869) | 3.6549 (0.9928) |  |
+| ogbg-molfreesolv | arma | fixed-rrog-T1-ns3 | rmse | 1 | 5.0683 (-0.8021) | 3.6823 (-0.7053) |  |
+| ogbg-molfreesolv | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 3.0142 (-0.0662) | 2.2399 (0.0032) |  |
+| ogbg-molfreesolv | film | fixed-rrog-T1-ns3 | rmse | 1 | 3.2952 (-0.1406) | 3.3042 (-0.3460) |  |
+| ogbg-molfreesolv | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 3.9984 (0.2103) | 2.5966 (0.1403) |  |
+| ogbg-molfreesolv | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 3.5888 (0.1285) | 2.4444 (0.0407) |  |
+| ogbg-molfreesolv | gen | fixed-rrog-T1-ns3 | rmse | 1 | 4.3009 (-0.3011) | 2.9063 (-0.3476) |  |
+| ogbg-molfreesolv | gin | fixed-rrog-T1-ns3 | rmse | 1 | 3.9743 (0.0447) | 3.4292 (0.0607) |  |
+| ogbg-molfreesolv | gine | fixed-rrog-T1-ns3 | rmse | 1 | 4.4468 (-1.1508) | 3.7405 (-0.5963) |  |
+| ogbg-molfreesolv | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 2.9106 (-0.3792) | 3.1429 (-0.3476) |  |
+| ogbg-molfreesolv | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 3.7380 (-0.2358) | 2.1931 (0.1046) |  |
+| ogbg-molfreesolv | mf | fixed-rrog-T1-ns3 | rmse | 1 | 2.5060 (0.2313) | 3.1892 (-0.3007) |  |
+| ogbg-molfreesolv | pna | fixed-rrog-T1-ns3 | rmse | 1 | 3.3334 (-0.9708) | 2.4279 (-0.1669) |  |
+| ogbg-molfreesolv | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 3.0920 (-0.6148) | 2.0244 (-0.0203) |  |
+| ogbg-molfreesolv | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 3.9261 (-0.0114) | 2.4887 (-0.0741) |  |
+| ogbg-molfreesolv | tag | fixed-rrog-T1-ns3 | rmse | 1 | 2.7359 (-0.0486) | 2.0588 (0.3237) |  |
+| ogbg-molfreesolv | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 4.4180 (-0.3237) | 2.4325 (-0.1120) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7543 (0.0238) | 0.7338 (0.0316) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7764 (-0.0055) | 0.6948 (-0.0299) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7801 (0.0097) | 0.7364 (0.0078) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 2 | 0.8009 (0.0356) | 0.7471 (-0.0089) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7721 (-0.0074) | 0.7281 (-0.0020) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7873 (0.0121) | 0.7333 (0.0077) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7658 (-0.0001) | 0.7446 (0.0071) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7805 (-0.0223) | 0.7496 (-0.0206) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7533 (-0.0254) | 0.7523 (0.0130) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7801 (-0.0008) | 0.7295 (-0.0035) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7891 (-0.0024) | 0.7362 (-0.0091) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7858 (0.0149) | 0.7134 (-0.0044) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 2 | 0.8303 (0.0422) | 0.7563 (-0.0004) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 2 | 0.8037 (0.0035) | 0.7404 (0.0203) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7632 (0.0046) | 0.6944 (-0.0116) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7565 (0.0131) | 0.7235 (-0.0136) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 2 | 0.7745 (0.0052) | 0.7573 (-0.0143) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-mollipo | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 0.8393 (0.0622) | 0.9174 (-0.0104) |  |
+| ogbg-mollipo | arma | fixed-rrog-T1-ns3 | rmse | 1 | 0.7173 (0.0152) | 0.7548 (-0.0253) |  |
+| ogbg-mollipo | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.6990 (0.0198) | 0.7132 (0.0048) |  |
+| ogbg-mollipo | film | fixed-rrog-T1-ns3 | rmse | 1 | 0.8122 (-0.0502) | 0.7353 (0.0018) |  |
+| ogbg-mollipo | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 0.7080 (-0.0215) | 0.7334 (-0.0026) |  |
+| ogbg-mollipo | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.7730 (-0.0351) | 0.7759 (0.0069) |  |
+| ogbg-mollipo | gen | fixed-rrog-T1-ns3 | rmse | 1 | 0.6594 (0.0452) | 0.7456 (-0.0077) |  |
+| ogbg-mollipo | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.6749 (0.0105) | 0.7073 (0.0317) |  |
+| ogbg-mollipo | gine | fixed-rrog-T1-ns3 | rmse | 1 | 0.7168 (-0.0553) | 0.7316 (0.0025) |  |
+| ogbg-mollipo | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 0.7372 (-0.0195) | 0.7396 (-0.0099) |  |
+| ogbg-mollipo | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.7184 (0.0055) | 0.7720 (0.0063) |  |
+| ogbg-mollipo | mf | fixed-rrog-T1-ns3 | rmse | 1 | 0.7050 (0.0080) | 0.7101 (0.0304) |  |
+| ogbg-mollipo | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.7466 (-0.0287) | 0.7908 (-0.0159) |  |
+| ogbg-mollipo | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.6766 (-0.0046) | 0.7144 (0.0126) |  |
+| ogbg-mollipo | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 0.7537 (-0.0032) | 0.7490 (0.0685) |  |
+| ogbg-mollipo | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.6743 (-0.0052) | 0.7201 (0.0026) |  |
+| ogbg-mollipo | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.6688 (0.0121) | 0.7396 (-0.0050) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-molhiv_T1_ns3_s2.log b/logs/ogbg-molhiv_T1_ns3_s2.log
new file mode 100644
index 0000000..106c985
--- /dev/null
+++ b/logs/ogbg-molhiv_T1_ns3_s2.log
@@ -0,0 +1,887 @@
+[run] ogbg-molhiv view=gin compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.77910 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.68080 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77909 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.71704 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.80998 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77192 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76713 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.79266 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.78636 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.78319 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s2] best_ep=50 val={'rocauc': 0.8099769743288261} test={'rocauc': 0.7394638753162479} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=gin compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.69602 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69894 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.70698 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75186 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.72072 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74483 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.72026 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.70869 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.71792 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.71924 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=40 val={'rocauc': 0.7518616500097983} test={'rocauc': 0.7650823693002955} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=gine compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.66907 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61855 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.71729 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.72027 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77864 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76000 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77539 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77798 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77431 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77560 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s2] best_ep=50 val={'rocauc': 0.7786351165980796} test={'rocauc': 0.7729069700071457} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=gine compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.64088 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.68459 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74306 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74743 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77208 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73219 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75738 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.78727 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77279 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.77796 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=80 val={'rocauc': 0.7872697432882618} test={'rocauc': 0.7010158558488964} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=gcn compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.70336 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75167 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77492 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.73994 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.74640 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75726 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.74487 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75292 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74965 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74658 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2] best_ep=30 val={'rocauc': 0.7749179404271997} test={'rocauc': 0.7569246219509841} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.70962 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75463 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77414 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76642 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75963 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76942 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.74167 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.72666 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.72509 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.71922 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=30 val={'rocauc': 0.7741386806780326} test={'rocauc': 0.7494157863226405} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=graphsage compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.72128 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.72150 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77123 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77651 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.74654 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75628 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75618 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.74948 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75841 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76074 halt=0.00 train_steps=1.00
+[ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s2] best_ep=40 val={'rocauc': 0.7765070791691162} test={'rocauc': 0.7610942660151799} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.66498 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69523 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.67164 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.73673 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76156 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75668 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77984 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77012 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75963 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76295 halt=0.00 train_steps=3.00
+[ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=70 val={'rocauc': 0.7798445767195766} test={'rocauc': 0.7146430019892235} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=gatv2 compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.74744 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.79311 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77594 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.79187 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.79288 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76908 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77367 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76684 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.76183 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76329 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s2] best_ep=20 val={'rocauc': 0.793114956888105} test={'rocauc': 0.7273817570829874} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.73573 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.68603 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.73567 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75925 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77616 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73973 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.74499 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73607 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.71758 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.72349 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=50 val={'rocauc': 0.7761641436409955} test={'rocauc': 0.724479035902586} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=graphconv compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.63604 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.73148 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.70977 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.73509 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.70662 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.72783 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.73062 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.72194 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.72680 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.72343 halt=0.00 train_steps=1.00
+[ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s2] best_ep=40 val={'rocauc': 0.7350884283754655} test={'rocauc': 0.7330423530775024} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.58868 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.69137 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75022 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75807 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76651 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74705 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.74788 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75848 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75069 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74481 halt=0.00 train_steps=3.00
+[ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=50 val={'rocauc': 0.7665068342151675} test={'rocauc': 0.7325112497344484} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=transformer compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.69418 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75507 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76184 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.71591 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.72909 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.70901 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.71042 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.68719 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.67989 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.68265 halt=0.00 train_steps=1.00
+[ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s2] best_ep=30 val={'rocauc': 0.7618435234175974} test={'rocauc': 0.7711736418239055} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.68567 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.72300 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74784 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.80434 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78556 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.78730 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.79940 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.79575 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.78924 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.79357 halt=0.00 train_steps=3.00
+[ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=40 val={'rocauc': 0.8043399715853421} test={'rocauc': 0.7765908959230575} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=pna compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.74594 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.79111 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.75091 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.76502 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.80199 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.76990 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.80667 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.80482 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.79585 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.79374 halt=0.00 train_steps=1.00
+[ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s2] best_ep=70 val={'rocauc': 0.8066731579463061} test={'rocauc': 0.7427663724676027} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=pna compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.71548 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.76199 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.68047 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.73278 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.71305 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.69991 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.76066 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.78164 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.77666 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.77992 halt=0.00 train_steps=3.00
+[ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=80 val={'rocauc': 0.7816358024691358} test={'rocauc': 0.7382085401417564} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=gen compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.71900 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.71850 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.73399 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.74417 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75591 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.73789 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.71291 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.72031 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.72306 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.72002 halt=0.00 train_steps=1.00
+[ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s2] best_ep=50 val={'rocauc': 0.7559125759357241} test={'rocauc': 0.7565596091079395} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=gen compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.71439 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.73103 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74792 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76761 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.69540 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73725 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.69090 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.69355 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.68226 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.68966 halt=0.00 train_steps=3.00
+[ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=40 val={'rocauc': 0.7676060650597687} test={'rocauc': 0.7570231174800596} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=film compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.77283 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.81397 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.79383 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77754 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.82146 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.81612 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77203 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76887 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.76402 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76533 halt=0.00 train_steps=1.00
+[ogbg-molhiv_film_classic_T0_ns1_h128_e100_s2] best_ep=50 val={'rocauc': 0.8214622525965118} test={'rocauc': 0.7396087216825356} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=film compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.67108 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.78932 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.78154 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.79131 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.81350 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.81917 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78007 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77893 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75079 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75276 halt=0.00 train_steps=3.00
+[ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=60 val={'rocauc': 0.8191688712522045} test={'rocauc': 0.7626895073292261} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=resgated compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.78854 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.74972 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.73903 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77422 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77706 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.72024 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.74393 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75405 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74059 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74289 halt=0.00 train_steps=1.00
+[ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s2] best_ep=10 val={'rocauc': 0.7885404418969234} test={'rocauc': 0.7547480638869041} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.69411 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76065 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77693 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.79870 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78910 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75895 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78474 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77994 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.78285 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.77767 halt=0.00 train_steps=3.00
+[ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=40 val={'rocauc': 0.7987029688418578} test={'rocauc': 0.7339867513856969} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=tag compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.61027 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.71861 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.75958 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.74046 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.69530 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.70296 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.71476 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.72258 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.71211 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.71320 halt=0.00 train_steps=1.00
+[ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s2] best_ep=30 val={'rocauc': 0.7595807613168722} test={'rocauc': 0.7552386102473976} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=tag compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.62604 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.67819 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.68679 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.72056 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.74401 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.70643 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75311 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.72758 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.72515 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.72985 halt=0.00 train_steps=3.00
+[ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=70 val={'rocauc': 0.753107853223594} test={'rocauc': 0.7545375538345662} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=sgc compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.69093 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75296 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76698 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.79015 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.78157 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.78165 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.78587 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.79278 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.78484 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.78554 halt=0.00 train_steps=1.00
+[ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s2] best_ep=80 val={'rocauc': 0.7927750832843425} test={'rocauc': 0.6994457212383398} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.70901 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76657 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74446 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.72625 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.73923 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.70795 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73050 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73530 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73443 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.73660 halt=0.00 train_steps=3.00
+[ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=20 val={'rocauc': 0.7665741965510485} test={'rocauc': 0.7427122964908555} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=cheb compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.70804 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76515 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77213 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.78377 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.78207 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.73918 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77829 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.79878 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.78798 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.78464 halt=0.00 train_steps=1.00
+[ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s2] best_ep=80 val={'rocauc': 0.7987825788751715} test={'rocauc': 0.7219181521466231} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.67440 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75268 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.79662 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77504 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71671 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.80921 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78234 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77931 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75698 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75325 halt=0.00 train_steps=3.00
+[ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=60 val={'rocauc': 0.8092084313149128} test={'rocauc': 0.7313505475192645} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=arma compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.67692 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.77171 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76832 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77600 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.73930 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75954 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.73086 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.74455 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74178 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74695 halt=0.00 train_steps=1.00
+[ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s2] best_ep=40 val={'rocauc': 0.7759957378012934} test={'rocauc': 0.7694818362656676} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=arma compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.64424 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76852 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75258 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.79405 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.79238 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77023 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75347 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.74261 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.74637 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74914 halt=0.00 train_steps=3.00
+[ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=40 val={'rocauc': 0.7940457818930041} test={'rocauc': 0.7463856003399061} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=mf compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.75488 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.77128 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.74323 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77356 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.74760 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.73409 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.73934 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.73559 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.73172 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.72801 halt=0.00 train_steps=1.00
+[ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2] best_ep=40 val={'rocauc': 0.7735645698608662} test={'rocauc': 0.769927963073833} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=mf compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.74171 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.77634 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74648 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74111 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76637 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73727 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.74356 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.71162 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.70819 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.69720 halt=0.00 train_steps=3.00
+[ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=20 val={'rocauc': 0.7763417352537723} test={'rocauc': 0.7111811738349525} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s2.json
+[run] ogbg-molhiv view=appnp compute=classic T=0 ns=1 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.71340 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.72133 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.68051 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.64824 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.64804 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.63197 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.61975 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.63096 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.63419 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.62975 halt=0.00 train_steps=1.00
+[ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s2] best_ep=20 val={'rocauc': 0.7213342641583382} test={'rocauc': 0.690191004075011} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s2.json
+[run] ogbg-molhiv view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:0
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molhiv --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 2 --device cuda:0
+ep10 val_rocauc=0.70306 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76196 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.72487 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.69525 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.72798 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.72291 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.74016 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.74633 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75092 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75032 halt=0.00 train_steps=3.00
+[ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2] best_ep=20 val={'rocauc': 0.7619568146188516} test={'rocauc': 0.72329708955368} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molfreesolv | appnp | rmse | 1 | 6.0462 +/- 0.0000 | 4.6478 +/- 0.0000 |
+| ogbg-molfreesolv | arma | rmse | 1 | 4.2662 +/- 0.0000 | 2.9769 +/- 0.0000 |
+| ogbg-molfreesolv | cheb | rmse | 1 | 2.9481 +/- 0.0000 | 2.2431 +/- 0.0000 |
+| ogbg-molfreesolv | film | rmse | 1 | 3.1546 +/- 0.0000 | 2.9581 +/- 0.0000 |
+| ogbg-molfreesolv | gatv2 | rmse | 1 | 4.2086 +/- 0.0000 | 2.7368 +/- 0.0000 |
+| ogbg-molfreesolv | gcn | rmse | 1 | 3.7172 +/- 0.0000 | 2.4851 +/- 0.0000 |
+| ogbg-molfreesolv | gen | rmse | 1 | 3.9998 +/- 0.0000 | 2.5588 +/- 0.0000 |
+| ogbg-molfreesolv | gin | rmse | 1 | 4.0190 +/- 0.0000 | 3.4898 +/- 0.0000 |
+| ogbg-molfreesolv | gine | rmse | 1 | 3.2961 +/- 0.0000 | 3.1442 +/- 0.0000 |
+| ogbg-molfreesolv | graphconv | rmse | 1 | 2.5314 +/- 0.0000 | 2.7953 +/- 0.0000 |
+| ogbg-molfreesolv | graphsage | rmse | 1 | 3.5022 +/- 0.0000 | 2.2977 +/- 0.0000 |
+| ogbg-molfreesolv | mf | rmse | 1 | 2.7374 +/- 0.0000 | 2.8885 +/- 0.0000 |
+| ogbg-molfreesolv | pna | rmse | 1 | 2.3625 +/- 0.0000 | 2.2610 +/- 0.0000 |
+| ogbg-molfreesolv | resgated | rmse | 1 | 2.4772 +/- 0.0000 | 2.0041 +/- 0.0000 |
+| ogbg-molfreesolv | sgc | rmse | 1 | 3.9147 +/- 0.0000 | 2.4146 +/- 0.0000 |
+| ogbg-molfreesolv | tag | rmse | 1 | 2.6874 +/- 0.0000 | 2.3826 +/- 0.0000 |
+| ogbg-molfreesolv | transformer | rmse | 1 | 4.0942 +/- 0.0000 | 2.3205 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 3 | 0.7274 +/- 0.0374 | 0.6982 +/- 0.0073 |
+| ogbg-molhiv | arma | rocauc | 3 | 0.7799 +/- 0.0063 | 0.7396 +/- 0.0263 |
+| ogbg-molhiv | cheb | rocauc | 3 | 0.7799 +/- 0.0207 | 0.7264 +/- 0.0039 |
+| ogbg-molhiv | film | rocauc | 3 | 0.7840 +/- 0.0421 | 0.7505 +/- 0.0298 |
+| ogbg-molhiv | gatv2 | rocauc | 3 | 0.7841 +/- 0.0088 | 0.7292 +/- 0.0262 |
+| ogbg-molhiv | gcn | rocauc | 3 | 0.7751 +/- 0.0003 | 0.7360 +/- 0.0190 |
+| ogbg-molhiv | gen | rocauc | 3 | 0.7626 +/- 0.0141 | 0.7438 +/- 0.0126 |
+| ogbg-molhiv | gin | rocauc | 3 | 0.8052 +/- 0.0145 | 0.7600 +/- 0.0179 |
+| ogbg-molhiv | gine | rocauc | 3 | 0.7787 +/- 0.0156 | 0.7505 +/- 0.0200 |
+| ogbg-molhiv | graphconv | rocauc | 3 | 0.7656 +/- 0.0284 | 0.7330 +/- 0.0222 |
+| ogbg-molhiv | graphsage | rocauc | 3 | 0.7865 +/- 0.0102 | 0.7506 +/- 0.0195 |
+| ogbg-molhiv | mf | rocauc | 3 | 0.7718 +/- 0.0137 | 0.7352 +/- 0.0319 |
+| ogbg-molhiv | pna | rocauc | 3 | 0.7943 +/- 0.0148 | 0.7520 +/- 0.0114 |
+| ogbg-molhiv | resgated | rocauc | 3 | 0.7963 +/- 0.0157 | 0.7316 +/- 0.0205 |
+| ogbg-molhiv | sgc | rocauc | 3 | 0.7699 +/- 0.0225 | 0.7038 +/- 0.0055 |
+| ogbg-molhiv | tag | rocauc | 3 | 0.7488 +/- 0.0133 | 0.7432 +/- 0.0156 |
+| ogbg-molhiv | transformer | rocauc | 3 | 0.7668 +/- 0.0086 | 0.7714 +/- 0.0168 |
+| ogbg-mollipo | appnp | rmse | 1 | 0.9015 +/- 0.0000 | 0.9070 +/- 0.0000 |
+| ogbg-mollipo | arma | rmse | 1 | 0.7325 +/- 0.0000 | 0.7295 +/- 0.0000 |
+| ogbg-mollipo | cheb | rmse | 1 | 0.7188 +/- 0.0000 | 0.7180 +/- 0.0000 |
+| ogbg-mollipo | film | rmse | 1 | 0.7620 +/- 0.0000 | 0.7371 +/- 0.0000 |
+| ogbg-mollipo | gatv2 | rmse | 1 | 0.6865 +/- 0.0000 | 0.7308 +/- 0.0000 |
+| ogbg-mollipo | gcn | rmse | 1 | 0.7379 +/- 0.0000 | 0.7828 +/- 0.0000 |
+| ogbg-mollipo | gen | rmse | 1 | 0.7046 +/- 0.0000 | 0.7379 +/- 0.0000 |
+| ogbg-mollipo | gin | rmse | 1 | 0.6854 +/- 0.0000 | 0.7390 +/- 0.0000 |
+| ogbg-mollipo | gine | rmse | 1 | 0.6615 +/- 0.0000 | 0.7341 +/- 0.0000 |
+| ogbg-mollipo | graphconv | rmse | 1 | 0.7178 +/- 0.0000 | 0.7297 +/- 0.0000 |
+| ogbg-mollipo | graphsage | rmse | 1 | 0.7239 +/- 0.0000 | 0.7783 +/- 0.0000 |
+| ogbg-mollipo | mf | rmse | 1 | 0.7129 +/- 0.0000 | 0.7405 +/- 0.0000 |
+| ogbg-mollipo | pna | rmse | 1 | 0.7179 +/- 0.0000 | 0.7749 +/- 0.0000 |
+| ogbg-mollipo | resgated | rmse | 1 | 0.6721 +/- 0.0000 | 0.7270 +/- 0.0000 |
+| ogbg-mollipo | sgc | rmse | 1 | 0.7505 +/- 0.0000 | 0.8176 +/- 0.0000 |
+| ogbg-mollipo | tag | rmse | 1 | 0.6692 +/- 0.0000 | 0.7227 +/- 0.0000 |
+| ogbg-mollipo | transformer | rmse | 1 | 0.6810 +/- 0.0000 | 0.7346 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molfreesolv | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 5.5593 (0.4869) | 3.6549 (0.9928) |  |
+| ogbg-molfreesolv | arma | fixed-rrog-T1-ns3 | rmse | 1 | 5.0683 (-0.8021) | 3.6823 (-0.7053) |  |
+| ogbg-molfreesolv | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 3.0142 (-0.0662) | 2.2399 (0.0032) |  |
+| ogbg-molfreesolv | film | fixed-rrog-T1-ns3 | rmse | 1 | 3.2952 (-0.1406) | 3.3042 (-0.3460) |  |
+| ogbg-molfreesolv | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 3.9984 (0.2103) | 2.5966 (0.1403) |  |
+| ogbg-molfreesolv | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 3.5888 (0.1285) | 2.4444 (0.0407) |  |
+| ogbg-molfreesolv | gen | fixed-rrog-T1-ns3 | rmse | 1 | 4.3009 (-0.3011) | 2.9063 (-0.3476) |  |
+| ogbg-molfreesolv | gin | fixed-rrog-T1-ns3 | rmse | 1 | 3.9743 (0.0447) | 3.4292 (0.0607) |  |
+| ogbg-molfreesolv | gine | fixed-rrog-T1-ns3 | rmse | 1 | 4.4468 (-1.1508) | 3.7405 (-0.5963) |  |
+| ogbg-molfreesolv | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 2.9106 (-0.3792) | 3.1429 (-0.3476) |  |
+| ogbg-molfreesolv | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 3.7380 (-0.2358) | 2.1931 (0.1046) |  |
+| ogbg-molfreesolv | mf | fixed-rrog-T1-ns3 | rmse | 1 | 2.5060 (0.2313) | 3.1892 (-0.3007) |  |
+| ogbg-molfreesolv | pna | fixed-rrog-T1-ns3 | rmse | 1 | 3.3334 (-0.9708) | 2.4279 (-0.1669) |  |
+| ogbg-molfreesolv | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 3.0920 (-0.6148) | 2.0244 (-0.0203) |  |
+| ogbg-molfreesolv | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 3.9261 (-0.0114) | 2.4887 (-0.0741) |  |
+| ogbg-molfreesolv | tag | fixed-rrog-T1-ns3 | rmse | 1 | 2.7359 (-0.0486) | 2.0588 (0.3237) |  |
+| ogbg-molfreesolv | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 4.4180 (-0.3237) | 2.4325 (-0.1120) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7568 (0.0294) | 0.7303 (0.0321) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7823 (0.0023) | 0.7120 (-0.0276) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7898 (0.0099) | 0.7347 (0.0083) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 3 | 0.8070 (0.0230) | 0.7523 (0.0018) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7734 (-0.0106) | 0.7269 (-0.0023) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7829 (0.0078) | 0.7386 (0.0026) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7664 (0.0038) | 0.7487 (0.0049) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7710 (-0.0342) | 0.7548 (-0.0052) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7646 (-0.0140) | 0.7352 (-0.0153) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7755 (0.0099) | 0.7305 (-0.0025) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7860 (-0.0005) | 0.7290 (-0.0216) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7826 (0.0109) | 0.7127 (-0.0225) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 3 | 0.8141 (0.0198) | 0.7503 (-0.0018) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 3 | 0.8020 (0.0057) | 0.7383 (0.0066) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7643 (-0.0056) | 0.7105 (0.0067) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7554 (0.0066) | 0.7339 (-0.0093) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7844 (0.0177) | 0.7637 (-0.0077) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-mollipo | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 0.8393 (0.0622) | 0.9174 (-0.0104) |  |
+| ogbg-mollipo | arma | fixed-rrog-T1-ns3 | rmse | 1 | 0.7173 (0.0152) | 0.7548 (-0.0253) |  |
+| ogbg-mollipo | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.6990 (0.0198) | 0.7132 (0.0048) |  |
+| ogbg-mollipo | film | fixed-rrog-T1-ns3 | rmse | 1 | 0.8122 (-0.0502) | 0.7353 (0.0018) |  |
+| ogbg-mollipo | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 0.7080 (-0.0215) | 0.7334 (-0.0026) |  |
+| ogbg-mollipo | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.7730 (-0.0351) | 0.7759 (0.0069) |  |
+| ogbg-mollipo | gen | fixed-rrog-T1-ns3 | rmse | 1 | 0.6594 (0.0452) | 0.7456 (-0.0077) |  |
+| ogbg-mollipo | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.6749 (0.0105) | 0.7073 (0.0317) |  |
+| ogbg-mollipo | gine | fixed-rrog-T1-ns3 | rmse | 1 | 0.7168 (-0.0553) | 0.7316 (0.0025) |  |
+| ogbg-mollipo | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 0.7372 (-0.0195) | 0.7396 (-0.0099) |  |
+| ogbg-mollipo | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.7184 (0.0055) | 0.7720 (0.0063) |  |
+| ogbg-mollipo | mf | fixed-rrog-T1-ns3 | rmse | 1 | 0.7050 (0.0080) | 0.7101 (0.0304) |  |
+| ogbg-mollipo | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.7466 (-0.0287) | 0.7908 (-0.0159) |  |
+| ogbg-mollipo | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.6766 (-0.0046) | 0.7144 (0.0126) |  |
+| ogbg-mollipo | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 0.7537 (-0.0032) | 0.7490 (0.0685) |  |
+| ogbg-mollipo | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.6743 (-0.0052) | 0.7201 (0.0026) |  |
+| ogbg-mollipo | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.6688 (0.0121) | 0.7396 (-0.0050) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-mollipo_0.log b/logs/ogbg-mollipo_0.log
new file mode 100644
index 0000000..e90fc69
--- /dev/null
+++ b/logs/ogbg-mollipo_0.log
@@ -0,0 +1,828 @@
+[run] ogbg-mollipo view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/lipophilicity.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 553.30it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/lipophilicity.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 4200/4200 [00:00<00:00, 163946.74it/s]
+Converting graphs into PyG objects...
+
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100%|██████████| 4200/4200 [00:00<00:00, 93692.57it/s]
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/ogb/graphproppred/dataset_pyg.py:158: UserWarning: The given NumPy array is not writable, and PyTorch does not support non-writable tensors. This means writing to this tensor will result in undefined behavior. You may want to copy the array to protect its data or make it writable before converting it to a tensor. This type of warning will be suppressed for the rest of this program. (Triggered internally at /pytorch/torch/csrc/utils/tensor_numpy.cpp:203.)
+  g.y = torch.from_numpy(graph_label[i]).view(1,-1).to(torch.float32)
+Done!
+Saving...
+ep10 val_rmse=1.44219 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.12619 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.83179 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.74595 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.80877 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.82527 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.68539 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.69580 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.69460 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.69261 halt=0.00 train_steps=1.00
+[ogbg-mollipo_gin_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.68539107)} test={'rmse': np.float32(0.73898196)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.96097 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.84203 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.76113 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.90551 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.74823 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.83854 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.71586 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.71676 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.68411 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.67485 halt=0.00 train_steps=3.00
+[ogbg-mollipo_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rmse': np.float32(0.67485154)} test={'rmse': np.float32(0.70725757)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.22610 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.78705 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.00198 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.73826 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.71839 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.75031 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.69282 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.67751 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.66306 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.66147 halt=0.00 train_steps=1.00
+[ogbg-mollipo_gine_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rmse': np.float32(0.6614736)} test={'rmse': np.float32(0.7341322)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.12481 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.90842 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.89875 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.79273 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.75853 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.76110 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.74986 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.71676 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.72387 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.71945 halt=0.00 train_steps=3.00
+[ogbg-mollipo_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.71676475)} test={'rmse': np.float32(0.7315849)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.00691 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.81827 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.14313 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.86043 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.79331 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.77473 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.74328 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.73790 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.74719 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.74553 halt=0.00 train_steps=1.00
+[ogbg-mollipo_gcn_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.7378985)} test={'rmse': np.float32(0.7828146)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.90662 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.86193 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.85537 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.80778 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.79127 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.77302 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.78860 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.78109 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.77706 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.77598 halt=0.00 train_steps=3.00
+[ogbg-mollipo_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rmse': np.float32(0.77302194)} test={'rmse': np.float32(0.7758825)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.81719 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.93272 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.73208 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.74760 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.75607 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.79079 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.72866 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.72390 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.73953 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.72610 halt=0.00 train_steps=1.00
+[ogbg-mollipo_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.7239026)} test={'rmse': np.float32(0.77830356)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.98259 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.85573 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.75527 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.71839 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.81340 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.72794 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.74447 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.74239 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.75862 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.74740 halt=0.00 train_steps=3.00
+[ogbg-mollipo_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rmse': np.float32(0.7183915)} test={'rmse': np.float32(0.7720211)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.82356 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.74744 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.81665 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.68648 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.68822 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.75184 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.69034 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.68654 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.69914 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.69418 halt=0.00 train_steps=1.00
+[ogbg-mollipo_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rmse': np.float32(0.6864759)} test={'rmse': np.float32(0.7307591)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.93766 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.80926 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.78557 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.79170 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.73680 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.72259 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.72328 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.71219 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.70799 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.70977 halt=0.00 train_steps=3.00
+[ogbg-mollipo_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.7079874)} test={'rmse': np.float32(0.7334003)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.09036 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.86879 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.76083 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.75326 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.76542 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.71961 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.75535 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.73062 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.72027 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.71776 halt=0.00 train_steps=1.00
+[ogbg-mollipo_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rmse': np.float32(0.71776384)} test={'rmse': np.float32(0.72967345)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.88607 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.97478 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.85444 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.79351 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.77852 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.76438 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.77003 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.73724 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.75021 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.74325 halt=0.00 train_steps=3.00
+[ogbg-mollipo_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.7372442)} test={'rmse': np.float32(0.7395755)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.21823 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.86985 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.76973 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.77144 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.68606 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.72351 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.72069 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.68095 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.68682 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.68128 halt=0.00 train_steps=1.00
+[ogbg-mollipo_transformer_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.68095195)} test={'rmse': np.float32(0.7346181)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.16083 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.81056 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.74514 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.74416 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.70391 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.67918 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.68572 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.68195 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.66882 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.67099 halt=0.00 train_steps=3.00
+[ogbg-mollipo_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.6688173)} test={'rmse': np.float32(0.739605)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rmse=0.83343 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.16403 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.80225 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.92289 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.78616 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.75145 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.71792 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.77899 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.72670 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.72765 halt=0.00 train_steps=1.00
+[ogbg-mollipo_pna_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.7179175)} test={'rmse': np.float32(0.7749425)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rmse=1.26267 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.86750 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.20236 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.84242 halt=0.00 train_steps=3.00
+ep50 val_rmse=1.01859 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.81805 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.76567 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.78532 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.74657 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.75037 halt=0.00 train_steps=3.00
+[ogbg-mollipo_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.74657387)} test={'rmse': np.float32(0.79080063)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.88033 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.86416 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.71604 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.74136 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.72750 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.72323 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.70463 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.71580 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.72020 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.72490 halt=0.00 train_steps=1.00
+[ogbg-mollipo_gen_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.7046298)} test={'rmse': np.float32(0.73787534)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.91516 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.75993 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.76272 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.71611 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.69283 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.67951 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.68466 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.66161 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.65941 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.66038 halt=0.00 train_steps=3.00
+[ogbg-mollipo_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.659409)} test={'rmse': np.float32(0.7455868)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.15311 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.86404 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.87620 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.85424 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.78557 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.80674 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.77620 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.76441 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.76459 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.76204 halt=0.00 train_steps=1.00
+[ogbg-mollipo_film_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rmse': np.float32(0.76203656)} test={'rmse': np.float32(0.73708737)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.04378 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.07263 halt=0.00 train_steps=3.00
+ep30 val_rmse=1.03795 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.93977 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.86991 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.86678 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.89066 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.81220 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.81562 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.81609 halt=0.00 train_steps=3.00
+[ogbg-mollipo_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.81220156)} test={'rmse': np.float32(0.7353014)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.80940 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.95162 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.82970 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.68267 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.67650 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.77591 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.67205 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.69964 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.67652 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.67709 halt=0.00 train_steps=1.00
+[ogbg-mollipo_resgated_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.67205405)} test={'rmse': np.float32(0.7270413)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.86604 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.90509 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.84402 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.78208 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.71021 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.69761 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.67663 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.69813 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.69587 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.69198 halt=0.00 train_steps=3.00
+[ogbg-mollipo_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.67663383)} test={'rmse': np.float32(0.7144216)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.83020 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.79246 halt=0.00 train_steps=1.00
+ep30 val_rmse=1.02107 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.68975 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.71873 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.68152 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.67573 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.68061 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.66915 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.67219 halt=0.00 train_steps=1.00
+[ogbg-mollipo_tag_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.66915077)} test={'rmse': np.float32(0.72267145)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.00532 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.85526 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.75036 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.77780 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.71127 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.70010 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.71614 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.70210 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.67431 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.67720 halt=0.00 train_steps=3.00
+[ogbg-mollipo_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.6743125)} test={'rmse': np.float32(0.7200687)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.82047 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.87298 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.89161 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.97082 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.75920 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.77458 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.75046 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.76128 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.75428 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.75227 halt=0.00 train_steps=1.00
+[ogbg-mollipo_sgc_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.75045776)} test={'rmse': np.float32(0.81755584)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.11783 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.90775 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.82430 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.79161 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.75791 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.77323 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.77519 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.76194 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.75368 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.76065 halt=0.00 train_steps=3.00
+[ogbg-mollipo_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.75368446)} test={'rmse': np.float32(0.74901825)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.94203 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.87526 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.79816 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.77105 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.75290 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.74494 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.75526 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.71994 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.71881 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.72252 halt=0.00 train_steps=1.00
+[ogbg-mollipo_cheb_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rmse': np.float32(0.7188114)} test={'rmse': np.float32(0.7179735)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.97792 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.86852 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.75930 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.71146 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.70679 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.70359 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.71828 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.69905 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.70087 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.70229 halt=0.00 train_steps=3.00
+[ogbg-mollipo_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.69904804)} test={'rmse': np.float32(0.7132058)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.89066 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.92272 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.78896 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.77896 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.76699 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.73378 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.76016 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.73247 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.73693 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.73897 halt=0.00 train_steps=1.00
+[ogbg-mollipo_arma_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rmse': np.float32(0.7324716)} test={'rmse': np.float32(0.7294971)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.87327 halt=0.00 train_steps=3.00
+ep20 val_rmse=1.01970 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.79921 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.71944 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.71726 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.76737 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.73058 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.76078 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.73802 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.73781 halt=0.00 train_steps=3.00
+[ogbg-mollipo_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rmse': np.float32(0.71726096)} test={'rmse': np.float32(0.75476235)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.86162 halt=0.00 train_steps=1.00
+ep20 val_rmse=0.85789 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.73809 halt=0.00 train_steps=1.00
+ep40 val_rmse=0.74146 halt=0.00 train_steps=1.00
+ep50 val_rmse=0.71292 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.73395 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.73997 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.73043 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.73206 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.73301 halt=0.00 train_steps=1.00
+[ogbg-mollipo_mf_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rmse': np.float32(0.7129222)} test={'rmse': np.float32(0.7404879)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=0.81723 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.80122 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.77347 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.77796 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.73664 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.72824 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.71114 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.72520 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.70653 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.70497 halt=0.00 train_steps=3.00
+[ogbg-mollipo_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=100 val={'rmse': np.float32(0.7049702)} test={'rmse': np.float32(0.7100952)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-mollipo view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.14396 halt=0.00 train_steps=1.00
+ep20 val_rmse=1.07213 halt=0.00 train_steps=1.00
+ep30 val_rmse=0.97016 halt=0.00 train_steps=1.00
+ep40 val_rmse=1.05400 halt=0.00 train_steps=1.00
+ep50 val_rmse=1.05925 halt=0.00 train_steps=1.00
+ep60 val_rmse=0.93170 halt=0.00 train_steps=1.00
+ep70 val_rmse=0.90754 halt=0.00 train_steps=1.00
+ep80 val_rmse=0.90773 halt=0.00 train_steps=1.00
+ep90 val_rmse=0.91195 halt=0.00 train_steps=1.00
+ep100 val_rmse=0.90148 halt=0.00 train_steps=1.00
+[ogbg-mollipo_appnp_classic_T0_ns1_h128_e100_s0] best_ep=100 val={'rmse': np.float32(0.901481)} test={'rmse': np.float32(0.9070075)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-mollipo view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-mollipo --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rmse=1.03741 halt=0.00 train_steps=3.00
+ep20 val_rmse=0.92784 halt=0.00 train_steps=3.00
+ep30 val_rmse=0.99124 halt=0.00 train_steps=3.00
+ep40 val_rmse=0.90729 halt=0.00 train_steps=3.00
+ep50 val_rmse=0.87637 halt=0.00 train_steps=3.00
+ep60 val_rmse=0.86910 halt=0.00 train_steps=3.00
+ep70 val_rmse=0.83926 halt=0.00 train_steps=3.00
+ep80 val_rmse=0.87004 halt=0.00 train_steps=3.00
+ep90 val_rmse=0.85671 halt=0.00 train_steps=3.00
+ep100 val_rmse=0.85874 halt=0.00 train_steps=3.00
+[ogbg-mollipo_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rmse': np.float32(0.8392647)} test={'rmse': np.float32(0.917393)} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-mollipo_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molfreesolv | appnp | rmse | 1 | 6.0462 +/- 0.0000 | 4.6478 +/- 0.0000 |
+| ogbg-molfreesolv | arma | rmse | 1 | 4.2662 +/- 0.0000 | 2.9769 +/- 0.0000 |
+| ogbg-molfreesolv | cheb | rmse | 1 | 2.9481 +/- 0.0000 | 2.2431 +/- 0.0000 |
+| ogbg-molfreesolv | film | rmse | 1 | 3.1546 +/- 0.0000 | 2.9581 +/- 0.0000 |
+| ogbg-molfreesolv | gatv2 | rmse | 1 | 4.2086 +/- 0.0000 | 2.7368 +/- 0.0000 |
+| ogbg-molfreesolv | gcn | rmse | 1 | 3.7172 +/- 0.0000 | 2.4851 +/- 0.0000 |
+| ogbg-molfreesolv | gen | rmse | 1 | 3.9998 +/- 0.0000 | 2.5588 +/- 0.0000 |
+| ogbg-molfreesolv | gin | rmse | 1 | 4.0190 +/- 0.0000 | 3.4898 +/- 0.0000 |
+| ogbg-molfreesolv | gine | rmse | 1 | 3.2961 +/- 0.0000 | 3.1442 +/- 0.0000 |
+| ogbg-molfreesolv | graphconv | rmse | 1 | 2.5314 +/- 0.0000 | 2.7953 +/- 0.0000 |
+| ogbg-molfreesolv | graphsage | rmse | 1 | 3.5022 +/- 0.0000 | 2.2977 +/- 0.0000 |
+| ogbg-molfreesolv | mf | rmse | 1 | 2.7374 +/- 0.0000 | 2.8885 +/- 0.0000 |
+| ogbg-molfreesolv | pna | rmse | 1 | 2.3625 +/- 0.0000 | 2.2610 +/- 0.0000 |
+| ogbg-molfreesolv | resgated | rmse | 1 | 2.4772 +/- 0.0000 | 2.0041 +/- 0.0000 |
+| ogbg-molfreesolv | sgc | rmse | 1 | 3.9147 +/- 0.0000 | 2.4146 +/- 0.0000 |
+| ogbg-molfreesolv | tag | rmse | 1 | 2.6874 +/- 0.0000 | 2.3826 +/- 0.0000 |
+| ogbg-molfreesolv | transformer | rmse | 1 | 4.0942 +/- 0.0000 | 2.3205 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-mollipo | appnp | rmse | 1 | 0.9015 +/- 0.0000 | 0.9070 +/- 0.0000 |
+| ogbg-mollipo | arma | rmse | 1 | 0.7325 +/- 0.0000 | 0.7295 +/- 0.0000 |
+| ogbg-mollipo | cheb | rmse | 1 | 0.7188 +/- 0.0000 | 0.7180 +/- 0.0000 |
+| ogbg-mollipo | film | rmse | 1 | 0.7620 +/- 0.0000 | 0.7371 +/- 0.0000 |
+| ogbg-mollipo | gatv2 | rmse | 1 | 0.6865 +/- 0.0000 | 0.7308 +/- 0.0000 |
+| ogbg-mollipo | gcn | rmse | 1 | 0.7379 +/- 0.0000 | 0.7828 +/- 0.0000 |
+| ogbg-mollipo | gen | rmse | 1 | 0.7046 +/- 0.0000 | 0.7379 +/- 0.0000 |
+| ogbg-mollipo | gin | rmse | 1 | 0.6854 +/- 0.0000 | 0.7390 +/- 0.0000 |
+| ogbg-mollipo | gine | rmse | 1 | 0.6615 +/- 0.0000 | 0.7341 +/- 0.0000 |
+| ogbg-mollipo | graphconv | rmse | 1 | 0.7178 +/- 0.0000 | 0.7297 +/- 0.0000 |
+| ogbg-mollipo | graphsage | rmse | 1 | 0.7239 +/- 0.0000 | 0.7783 +/- 0.0000 |
+| ogbg-mollipo | mf | rmse | 1 | 0.7129 +/- 0.0000 | 0.7405 +/- 0.0000 |
+| ogbg-mollipo | pna | rmse | 1 | 0.7179 +/- 0.0000 | 0.7749 +/- 0.0000 |
+| ogbg-mollipo | resgated | rmse | 1 | 0.6721 +/- 0.0000 | 0.7270 +/- 0.0000 |
+| ogbg-mollipo | sgc | rmse | 1 | 0.7505 +/- 0.0000 | 0.8176 +/- 0.0000 |
+| ogbg-mollipo | tag | rmse | 1 | 0.6692 +/- 0.0000 | 0.7227 +/- 0.0000 |
+| ogbg-mollipo | transformer | rmse | 1 | 0.6810 +/- 0.0000 | 0.7346 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molfreesolv | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 5.5593 (0.4869) | 3.6549 (0.9928) |  |
+| ogbg-molfreesolv | arma | fixed-rrog-T1-ns3 | rmse | 1 | 5.0683 (-0.8021) | 3.6823 (-0.7053) |  |
+| ogbg-molfreesolv | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 3.0142 (-0.0662) | 2.2399 (0.0032) |  |
+| ogbg-molfreesolv | film | fixed-rrog-T1-ns3 | rmse | 1 | 3.2952 (-0.1406) | 3.3042 (-0.3460) |  |
+| ogbg-molfreesolv | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 3.9984 (0.2103) | 2.5966 (0.1403) |  |
+| ogbg-molfreesolv | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 3.5888 (0.1285) | 2.4444 (0.0407) |  |
+| ogbg-molfreesolv | gen | fixed-rrog-T1-ns3 | rmse | 1 | 4.3009 (-0.3011) | 2.9063 (-0.3476) |  |
+| ogbg-molfreesolv | gin | fixed-rrog-T1-ns3 | rmse | 1 | 3.9743 (0.0447) | 3.4292 (0.0607) |  |
+| ogbg-molfreesolv | gine | fixed-rrog-T1-ns3 | rmse | 1 | 4.4468 (-1.1508) | 3.7405 (-0.5963) |  |
+| ogbg-molfreesolv | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 2.9106 (-0.3792) | 3.1429 (-0.3476) |  |
+| ogbg-molfreesolv | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 3.7380 (-0.2358) | 2.1931 (0.1046) |  |
+| ogbg-molfreesolv | mf | fixed-rrog-T1-ns3 | rmse | 1 | 2.5060 (0.2313) | 3.1892 (-0.3007) |  |
+| ogbg-molfreesolv | pna | fixed-rrog-T1-ns3 | rmse | 1 | 3.3334 (-0.9708) | 2.4279 (-0.1669) |  |
+| ogbg-molfreesolv | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 3.0920 (-0.6148) | 2.0244 (-0.0203) |  |
+| ogbg-molfreesolv | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 3.9261 (-0.0114) | 2.4887 (-0.0741) |  |
+| ogbg-molfreesolv | tag | fixed-rrog-T1-ns3 | rmse | 1 | 2.7359 (-0.0486) | 2.0588 (0.3237) |  |
+| ogbg-molfreesolv | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 4.4180 (-0.3237) | 2.4325 (-0.1120) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7956 (0.0084) | 0.6967 (-0.0329) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7947 (0.0116) | 0.7290 (0.0008) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8251 (0.0330) | 0.7725 (-0.0117) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7740 (0.0210) | 0.7590 (0.0276) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7754 (-0.0091) | 0.7115 (0.0041) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7923 (-0.0221) | 0.7227 (-0.0015) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7659 (0.0181) | 0.7136 (0.0117) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7717 (0.0189) | 0.7181 (-0.0074) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-mollipo | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 0.8393 (0.0622) | 0.9174 (-0.0104) |  |
+| ogbg-mollipo | arma | fixed-rrog-T1-ns3 | rmse | 1 | 0.7173 (0.0152) | 0.7548 (-0.0253) |  |
+| ogbg-mollipo | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.6990 (0.0198) | 0.7132 (0.0048) |  |
+| ogbg-mollipo | film | fixed-rrog-T1-ns3 | rmse | 1 | 0.8122 (-0.0502) | 0.7353 (0.0018) |  |
+| ogbg-mollipo | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 0.7080 (-0.0215) | 0.7334 (-0.0026) |  |
+| ogbg-mollipo | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.7730 (-0.0351) | 0.7759 (0.0069) |  |
+| ogbg-mollipo | gen | fixed-rrog-T1-ns3 | rmse | 1 | 0.6594 (0.0452) | 0.7456 (-0.0077) |  |
+| ogbg-mollipo | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.6749 (0.0105) | 0.7073 (0.0317) |  |
+| ogbg-mollipo | gine | fixed-rrog-T1-ns3 | rmse | 1 | 0.7168 (-0.0553) | 0.7316 (0.0025) |  |
+| ogbg-mollipo | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 0.7372 (-0.0195) | 0.7396 (-0.0099) |  |
+| ogbg-mollipo | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.7184 (0.0055) | 0.7720 (0.0063) |  |
+| ogbg-mollipo | mf | fixed-rrog-T1-ns3 | rmse | 1 | 0.7050 (0.0080) | 0.7101 (0.0304) |  |
+| ogbg-mollipo | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.7466 (-0.0287) | 0.7908 (-0.0159) |  |
+| ogbg-mollipo | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.6766 (-0.0046) | 0.7144 (0.0126) |  |
+| ogbg-mollipo | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 0.7537 (-0.0032) | 0.7490 (0.0685) |  |
+| ogbg-mollipo | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.6743 (-0.0052) | 0.7201 (0.0026) |  |
+| ogbg-mollipo | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.6688 (0.0121) | 0.7396 (-0.0050) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-molsider_0.log b/logs/ogbg-molsider_0.log
new file mode 100644
index 0000000..0b371dd
--- /dev/null
+++ b/logs/ogbg-molsider_0.log
@@ -0,0 +1,791 @@
+[run] ogbg-molsider view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/sider.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 1028.52it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/sider.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 1427/1427 [00:00<00:00, 150127.22it/s]
+Converting graphs into PyG objects...
+
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100%|██████████| 1427/1427 [00:00<00:00, 92956.32it/s]
+Done!
+Saving...
+ep10 val_rocauc=0.59998 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.59649 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.60635 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.60066 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.62251 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.59834 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.61516 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61770 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61353 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61284 halt=0.00 train_steps=1.00
+[ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.6225119550298882} test={'rocauc': 0.5748427490288601} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.55926 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.57865 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.59569 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.60464 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.60342 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.60306 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.59942 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.59515 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.59567 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.59471 halt=0.00 train_steps=3.00
+[ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.6046415841313262} test={'rocauc': 0.6022262654061706} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.57210 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.60097 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.63266 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.60286 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.63200 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61688 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.61584 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61124 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61384 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61372 halt=0.00 train_steps=1.00
+[ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.6326628393175155} test={'rocauc': 0.5494595931506057} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.57630 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.57665 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.61413 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.60975 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.60021 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.60710 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.61292 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61510 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.61014 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61216 halt=0.00 train_steps=3.00
+[ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.6151020149803161} test={'rocauc': 0.6150033205476824} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.61091 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61064 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61573 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.61813 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.62650 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.62929 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.62581 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.62136 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.62459 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.62346 halt=0.00 train_steps=1.00
+[ogbg-molsider_gcn_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.6292912980815916} test={'rocauc': 0.6086409341357526} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60191 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.61249 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.61906 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.62066 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62557 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61451 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.60594 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.59722 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.59952 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.59795 halt=0.00 train_steps=3.00
+[ogbg-molsider_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.6255728102145075} test={'rocauc': 0.6117391432513807} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.58674 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.58094 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.60485 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.61084 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61680 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61895 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.62174 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61558 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61656 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61703 halt=0.00 train_steps=1.00
+[ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rocauc': 0.621744356636161} test={'rocauc': 0.5807259430259354} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.56277 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.59348 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.61719 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.61687 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.61698 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61652 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.62323 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61811 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.62049 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.62090 halt=0.00 train_steps=3.00
+[ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.62323063286361} test={'rocauc': 0.5860528009903617} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.58304 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.57852 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.59416 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.59244 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.60712 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.60425 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.59828 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.60123 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.59888 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.59847 halt=0.00 train_steps=1.00
+[ogbg-molsider_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.6071193037623003} test={'rocauc': 0.6013146804327355} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60054 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.64196 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.64053 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.62910 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.64482 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.63459 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.64623 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.64575 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.64370 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.64299 halt=0.00 train_steps=3.00
+[ogbg-molsider_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.6462276348941932} test={'rocauc': 0.6000090607166413} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.55570 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.56965 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.58316 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.58130 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.59132 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.58874 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.59208 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.59036 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.59140 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.59058 halt=0.00 train_steps=1.00
+[ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rocauc': 0.5920839065175088} test={'rocauc': 0.6151152605717433} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.58918 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.58796 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.56951 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.59408 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.60103 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.59308 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.59720 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.60063 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.59957 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.59797 halt=0.00 train_steps=3.00
+[ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.6010260045148574} test={'rocauc': 0.5962935439480032} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.58334 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.59636 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.59459 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.60645 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61370 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61596 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.61576 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61199 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61222 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61204 halt=0.00 train_steps=1.00
+[ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.6159576666835939} test={'rocauc': 0.5979944408282211} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.56667 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.61114 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.63153 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.62209 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62301 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.62593 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.63126 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.62696 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.62548 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.62739 halt=0.00 train_steps=3.00
+[ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.6315255937485902} test={'rocauc': 0.6190391448308609} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.55982 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.59234 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.61111 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.58299 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.60685 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.62185 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.60470 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.61194 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.61402 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.61464 halt=0.00 train_steps=1.00
+[ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.6218537848171463} test={'rocauc': 0.5964761418261523} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.54779 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.60243 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.58203 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.60096 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.59878 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.60578 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.58584 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.58530 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.58392 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.58777 halt=0.00 train_steps=3.00
+[ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.6057840094519997} test={'rocauc': 0.5721280929989979} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60840 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.63552 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.63952 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.62215 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.64615 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.65194 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.63873 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.63856 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.63452 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.63538 halt=0.00 train_steps=1.00
+[ogbg-molsider_gen_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.6519400080762945} test={'rocauc': 0.5853709823208472} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.59093 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.62954 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.63446 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.60170 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62382 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.62117 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.62097 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61863 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.62028 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61721 halt=0.00 train_steps=3.00
+[ogbg-molsider_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.634456224198147} test={'rocauc': 0.6052572461025753} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.56261 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.59192 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.57198 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.60244 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.59915 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.59471 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.59074 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.58910 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.58985 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.58862 halt=0.00 train_steps=1.00
+[ogbg-molsider_film_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.6024369569728498} test={'rocauc': 0.5898473664808705} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.51731 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.52320 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.53502 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.56129 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.56964 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.56673 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.57611 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.58625 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.58365 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.58428 halt=0.00 train_steps=3.00
+[ogbg-molsider_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.5862480936504801} test={'rocauc': 0.5974246609585021} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.58052 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.58176 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61682 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.62095 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61876 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61691 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.60859 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61184 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61061 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.61120 halt=0.00 train_steps=1.00
+[ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.6209450264359846} test={'rocauc': 0.5910349402024013} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.57253 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.59538 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.58400 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.59174 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.60608 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61153 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.62045 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61194 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.61006 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61185 halt=0.00 train_steps=3.00
+[ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.6204543981100222} test={'rocauc': 0.5960257361986486} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60321 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.59623 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61421 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.60999 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.62420 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.64385 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.63472 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.63479 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.63731 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.63690 halt=0.00 train_steps=1.00
+[ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.6438543175768482} test={'rocauc': 0.6143146363395369} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.59832 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.60583 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.64103 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.62028 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.60728 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.59256 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.61016 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61088 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.60864 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.60813 halt=0.00 train_steps=3.00
+[ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.6410300955419639} test={'rocauc': 0.6101942928754263} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.59227 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61737 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61472 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.59858 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.60533 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.60972 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.60069 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.59499 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.59580 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.59745 halt=0.00 train_steps=1.00
+[ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.6173711459877224} test={'rocauc': 0.6042590538050838} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.61330 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.61513 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.61384 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.57702 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.57664 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.58877 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.59580 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.58773 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.59049 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.58891 halt=0.00 train_steps=3.00
+[ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.6151272572948054} test={'rocauc': 0.6417135077812745} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.60224 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.62375 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.60603 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.61966 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61314 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61864 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.61346 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.61142 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.61044 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.60962 halt=0.00 train_steps=1.00
+[ogbg-molsider_cheb_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.6237482002412537} test={'rocauc': 0.6033376509930031} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.61499 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.60610 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.62630 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.61510 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.61589 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61747 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.61544 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61255 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.61285 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61380 halt=0.00 train_steps=3.00
+[ogbg-molsider_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.626299014853098} test={'rocauc': 0.609583177772403} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.59751 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.61701 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61715 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.61968 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.61175 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61134 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.62727 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.62541 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.62276 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.62386 halt=0.00 train_steps=1.00
+[ogbg-molsider_arma_classic_T0_ns1_h128_e100_s0] best_ep=70 val={'rocauc': 0.627268343131736} test={'rocauc': 0.6158698228431547} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.63436 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.63097 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.61695 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.61548 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.62918 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.61098 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.62615 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61707 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.61543 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.61589 halt=0.00 train_steps=3.00
+[ogbg-molsider_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=10 val={'rocauc': 0.634361816858312} test={'rocauc': 0.6140829013811058} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.59801 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.60524 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.61935 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.61784 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.62023 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.61158 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.60329 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.60474 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.60661 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.60496 halt=0.00 train_steps=1.00
+[ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.6202255900567958} test={'rocauc': 0.586091595334005} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.61285 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.61899 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.59711 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.59241 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.59907 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.59999 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.60594 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.61000 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.60699 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.60725 halt=0.00 train_steps=3.00
+[ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.6189914567323086} test={'rocauc': 0.598312638550014} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-molsider view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.53840 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.56523 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.57212 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.58346 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.58830 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.58548 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.58753 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.58862 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.58825 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.58828 halt=0.00 train_steps=1.00
+[ogbg-molsider_appnp_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rocauc': 0.5886184927786781} test={'rocauc': 0.6003864841212386} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-molsider view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-molsider --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.54410 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.56171 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.58622 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.59376 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.58304 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.58067 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.57910 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.57938 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.57906 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.58071 halt=0.00 train_steps=3.00
+[ogbg-molsider_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=40 val={'rocauc': 0.5937589012949048} test={'rocauc': 0.5905116380584287} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-molsider_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8251 (0.0330) | 0.7725 (-0.0117) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7740 (0.0210) | 0.7590 (0.0276) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7923 (-0.0221) | 0.7227 (-0.0015) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/logs/ogbg-moltox21_0.log b/logs/ogbg-moltox21_0.log
new file mode 100644
index 0000000..b345f4f
--- /dev/null
+++ b/logs/ogbg-moltox21_0.log
@@ -0,0 +1,720 @@
+[run] ogbg-moltox21 view=gin compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gin --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+Downloading http://snap.stanford.edu/ogb/data/graphproppred/csv_mol_download/tox21.zip
+
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Downloaded 0.00 GB: 100%|██████████| 2/2 [00:00<00:00, 386.29it/s]
+Processing...
+Extracting /orion/u/oscarwan/rrog-gnn-runner/data/ogb/tox21.zip
+Loading necessary files...
+This might take a while.
+Processing graphs...
+
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100%|██████████| 7831/7831 [00:00<00:00, 157806.81it/s]
+Converting graphs into PyG objects...
+
  0%|          | 0/7831 [00:00<?, ?it/s]
100%|██████████| 7831/7831 [00:00<00:00, 92490.76it/s]
+Done!
+Saving...
+ep10 val_rocauc=0.72484 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.74846 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76490 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76215 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76595 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76742 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76664 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76598 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.76901 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76838 halt=0.00 train_steps=1.00
+[ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rocauc': 0.769011087128982} test={'rocauc': 0.724182297150406} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=gin compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gin --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.69793 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74054 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.74514 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74791 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.74986 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75586 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76768 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76774 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77178 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76931 halt=0.00 train_steps=3.00
+[ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=90 val={'rocauc': 0.7717759383538949} test={'rocauc': 0.7236697240762989} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=gine compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gine --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.68818 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.74111 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76789 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77438 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76547 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77108 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77342 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77174 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77180 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77312 halt=0.00 train_steps=1.00
+[ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.7743797903105913} test={'rocauc': 0.7328494551753418} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=gine compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gine --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.73735 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.72683 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75433 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75925 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75777 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75932 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76220 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75791 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76164 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76080 halt=0.00 train_steps=3.00
+[ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.7622004073608938} test={'rocauc': 0.7193472376632882} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=gcn compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gcn --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.73863 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75645 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.75601 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.75802 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75053 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75210 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75306 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75621 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75552 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75553 halt=0.00 train_steps=1.00
+[ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.7580202023804351} test={'rocauc': 0.7170910489918559} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=gcn compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gcn --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74119 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75287 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75370 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74513 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75475 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.74906 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.75844 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.75876 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75769 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75797 halt=0.00 train_steps=3.00
+[ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.7587559779881515} test={'rocauc': 0.7230304767127982} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=graphsage compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view graphsage --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77089 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76511 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76566 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76254 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76285 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75888 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76083 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75760 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75699 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75730 halt=0.00 train_steps=1.00
+[ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.7708912322116328} test={'rocauc': 0.719565697251165} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=graphsage compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view graphsage --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.76513 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75758 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75776 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.75918 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.75893 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76388 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76881 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76966 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76845 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76888 halt=0.00 train_steps=3.00
+[ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=80 val={'rocauc': 0.7696559719157566} test={'rocauc': 0.7204917205278893} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=gatv2 compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gatv2 --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74480 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76272 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.75593 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.75003 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.74890 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75069 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.74928 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.74860 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74783 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.74736 halt=0.00 train_steps=1.00
+[ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.7627170708797383} test={'rocauc': 0.7159809011324226} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=gatv2 compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gatv2 --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74054 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76240 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76147 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76879 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77341 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77619 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76905 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77076 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76778 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76949 halt=0.00 train_steps=3.00
+[ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.7761905248713933} test={'rocauc': 0.7302941629609098} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=graphconv compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view graphconv --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.78311 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.77225 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77248 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77295 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77354 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77640 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77229 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76658 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.76913 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76699 halt=0.00 train_steps=1.00
+[ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0] best_ep=10 val={'rocauc': 0.7831111293212308} test={'rocauc': 0.7147413214946693} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=graphconv compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view graphconv --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77949 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.77294 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77430 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76989 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77667 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77827 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.78203 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.78104 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.78098 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.77874 halt=0.00 train_steps=3.00
+[ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=70 val={'rocauc': 0.7820316625768228} test={'rocauc': 0.7313192526985618} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=transformer compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view transformer --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.75425 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75934 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76560 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76268 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75813 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.75738 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75319 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75603 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75327 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75372 halt=0.00 train_steps=1.00
+[ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.7656017658932041} test={'rocauc': 0.7309364489214464} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=transformer compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view transformer --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74194 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.77615 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77483 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77105 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76520 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77096 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76318 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76083 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75785 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75802 halt=0.00 train_steps=3.00
+[ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=20 val={'rocauc': 0.7761466167802987} test={'rocauc': 0.7291784660085319} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=pna compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view pna --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.72096 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.73688 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.73962 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.70380 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.75643 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.75674 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.76476 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.76170 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.76597 halt=0.00 train_steps=1.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.76447 halt=0.00 train_steps=1.00
+[ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0] best_ep=90 val={'rocauc': 0.7659664923974269} test={'rocauc': 0.6945744978582721} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=pna compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view pna --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep10 val_rocauc=0.58022 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep20 val_rocauc=0.74452 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep30 val_rocauc=0.76386 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep40 val_rocauc=0.74277 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep50 val_rocauc=0.77445 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep60 val_rocauc=0.76062 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep70 val_rocauc=0.75774 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep80 val_rocauc=0.75313 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep90 val_rocauc=0.75465 halt=0.00 train_steps=3.00
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='min')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+/orion/u/oscarwan/rrog-gnn-runner/.venv/lib/python3.13/site-packages/torch_geometric/utils/_scatter.py:91: UserWarning: The usage of `scatter(reduce='max')` can be accelerated via the 'torch-scatter' package, but it was not found
+  warnings.warn(
+ep100 val_rocauc=0.75579 halt=0.00 train_steps=3.00
+[ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7744523976361245} test={'rocauc': 0.7348793665704174} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=gen compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gen --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.75728 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76274 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77508 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.78345 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77692 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77932 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77949 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77426 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77385 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77440 halt=0.00 train_steps=1.00
+[ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.783453783540323} test={'rocauc': 0.744374172706925} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=gen compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view gen --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.76453 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76862 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77571 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77411 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76511 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75944 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76283 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76241 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76247 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76180 halt=0.00 train_steps=3.00
+[ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7757089729043948} test={'rocauc': 0.7312107536918231} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=film compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view film --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74814 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75905 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76794 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76664 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77020 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76890 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76708 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76375 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.76202 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76131 halt=0.00 train_steps=1.00
+[ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0] best_ep=50 val={'rocauc': 0.7701993310949509} test={'rocauc': 0.7160313530552065} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=film compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view film --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.72171 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76173 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.77267 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77175 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76336 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75720 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76378 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76209 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.75798 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.75964 halt=0.00 train_steps=3.00
+[ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7726742190325983} test={'rocauc': 0.7369411241728653} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=resgated compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view resgated --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.73425 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.79504 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77782 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77016 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77961 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77546 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77802 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77498 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77436 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77488 halt=0.00 train_steps=1.00
+[ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.7950359690969749} test={'rocauc': 0.7275455467914984} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=resgated compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view resgated --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77024 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.78122 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75711 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.77733 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78866 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.78069 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77869 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77797 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77717 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.77679 halt=0.00 train_steps=3.00
+[ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7886618095832292} test={'rocauc': 0.7379821725919018} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=tag compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view tag --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.77020 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75053 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.77475 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.78655 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.77357 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.78210 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77541 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77523 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77610 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77533 halt=0.00 train_steps=1.00
+[ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0] best_ep=40 val={'rocauc': 0.7865543605336435} test={'rocauc': 0.7415570498308578} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=tag compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view tag --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.76097 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.75558 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76705 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76024 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.78386 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77078 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.77584 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.77648 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.77944 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.77766 halt=0.00 train_steps=3.00
+[ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7838617216718421} test={'rocauc': 0.7341723374058734} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=sgc compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view sgc --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74042 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.75125 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76111 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.75660 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75361 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.74742 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75373 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75183 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.75155 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75209 halt=0.00 train_steps=1.00
+[ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.7611119280457176} test={'rocauc': 0.7239907988668123} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=sgc compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view sgc --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.73403 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74782 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.75058 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.74249 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.74208 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.73304 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.73890 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.73793 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.73960 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.74013 halt=0.00 train_steps=3.00
+[ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7505837592258088} test={'rocauc': 0.7354997840876948} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=cheb compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view cheb --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74437 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.77175 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.78344 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76996 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76678 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76659 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.76423 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.76039 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.76311 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.76377 halt=0.00 train_steps=1.00
+[ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0] best_ep=30 val={'rocauc': 0.7834436091147085} test={'rocauc': 0.7300685430388674} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=cheb compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view cheb --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.73591 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.74295 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76362 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76600 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.77099 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.75645 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76291 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76312 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76302 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76310 halt=0.00 train_steps=3.00
+[ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=50 val={'rocauc': 0.7709868045619044} test={'rocauc': 0.7285529943614071} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=arma compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view arma --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.75328 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.76333 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76992 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.77239 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.76722 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.77990 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.77874 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.77721 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.77836 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.77654 halt=0.00 train_steps=1.00
+[ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0] best_ep=60 val={'rocauc': 0.7798972501326612} test={'rocauc': 0.7222812510383411} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=arma compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view arma --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74841 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76256 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76827 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76564 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76598 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.77710 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76482 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76599 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76783 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76711 halt=0.00 train_steps=3.00
+[ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.7770957435163162} test={'rocauc': 0.7208970968150412} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=mf compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view mf --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74780 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.77726 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.76923 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.76854 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.75343 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.76215 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.75537 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.75354 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.74992 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.75063 halt=0.00 train_steps=1.00
+[ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0] best_ep=20 val={'rocauc': 0.7772586253147277} test={'rocauc': 0.7280600105159073} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=mf compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view mf --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.74625 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.76664 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.76949 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.76083 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.76381 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.76172 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.76629 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.76347 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.76494 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.76533 halt=0.00 train_steps=3.00
+[ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=30 val={'rocauc': 0.7694895755359669} test={'rocauc': 0.7278719227082299} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
+[run] ogbg-moltox21 view=appnp compute=classic T=0 ns=1 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view appnp --compute classic --T 0 --n_sup 1 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.72363 halt=0.00 train_steps=1.00
+ep20 val_rocauc=0.71790 halt=0.00 train_steps=1.00
+ep30 val_rocauc=0.71516 halt=0.00 train_steps=1.00
+ep40 val_rocauc=0.71924 halt=0.00 train_steps=1.00
+ep50 val_rocauc=0.72352 halt=0.00 train_steps=1.00
+ep60 val_rocauc=0.72489 halt=0.00 train_steps=1.00
+ep70 val_rocauc=0.72364 halt=0.00 train_steps=1.00
+ep80 val_rocauc=0.72546 halt=0.00 train_steps=1.00
+ep90 val_rocauc=0.72334 halt=0.00 train_steps=1.00
+ep100 val_rocauc=0.72316 halt=0.00 train_steps=1.00
+[ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0] best_ep=80 val={'rocauc': 0.7254553558600404} test={'rocauc': 0.7158488769446065} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0.json
+[run] ogbg-moltox21 view=appnp compute=fixed-rrog T=1 ns=3 device=cuda:1
+python3 rrog/train_ogb_graphprop.py --dataset ogbg-moltox21 --view appnp --compute fixed-rrog --T 1 --n_sup 3 --hidden 128 --bs 128 --epochs 100 --eval_every 10 --agg_layers 5 --compute_layers 2 --seed 0 --device cuda:1
+ep10 val_rocauc=0.71227 halt=0.00 train_steps=3.00
+ep20 val_rocauc=0.71980 halt=0.00 train_steps=3.00
+ep30 val_rocauc=0.71066 halt=0.00 train_steps=3.00
+ep40 val_rocauc=0.71010 halt=0.00 train_steps=3.00
+ep50 val_rocauc=0.71681 halt=0.00 train_steps=3.00
+ep60 val_rocauc=0.72800 halt=0.00 train_steps=3.00
+ep70 val_rocauc=0.71901 halt=0.00 train_steps=3.00
+ep80 val_rocauc=0.72089 halt=0.00 train_steps=3.00
+ep90 val_rocauc=0.72352 halt=0.00 train_steps=3.00
+ep100 val_rocauc=0.72217 halt=0.00 train_steps=3.00
+[ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0] best_ep=60 val={'rocauc': 0.7279951275996247} test={'rocauc': 0.7153555287245948} adaptive=None steps=None
+  wrote /orion/u/oscarwan/rrog-gnn-runner/runs/ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
+
+Classic baseline: task x backbone
+| task | backbone | metric | n | val | test |
+| --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
+| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
+| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
+| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
+| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
+| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
+| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
+| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
+| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
+| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
+| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
+| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
+| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
+| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
+| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
+| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
+
+Delta vs matching classic
+| task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
+| --- | --- | --- | --- | --- | --- | --- | --- |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8049 (0.0214) | 0.7486 (-0.0077) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7833 (0.0079) | 0.7448 (0.0250) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0457) | 0.7668 (-0.0056) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7490 (-0.0453) | 0.7376 (-0.0070) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7817 (0.0110) | 0.7493 (0.0385) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7893 (-0.0075) | 0.7633 (0.0008) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8097 (0.0317) | 0.7602 (-0.0046) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7838 (0.0221) | 0.7648 (0.0100) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
diff --git a/runs/ogbg-molbace_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..e30e682
--- /dev/null
+++ b/runs/ogbg-molbace_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 17.3,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.6564102564102564
+  },
+  "test": {
+    "rocauc": 0.7423056859676577
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..c30d31f
--- /dev/null
+++ b/runs/ogbg-molbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 20.1,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.7168498168498169
+  },
+  "test": {
+    "rocauc": 0.7209181011997913
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4d18ef2
--- /dev/null
+++ b/runs/ogbg-molbace_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 30.6,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.6923076923076924
+  },
+  "test": {
+    "rocauc": 0.7838636758824552
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8090a35
--- /dev/null
+++ b/runs/ogbg-molbace_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 38.9,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.717948717948718
+  },
+  "test": {
+    "rocauc": 0.7671709267953399
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ffd0717
--- /dev/null
+++ b/runs/ogbg-molbace_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 15.4,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.7267399267399268
+  },
+  "test": {
+    "rocauc": 0.7969048861067639
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..0fec992
--- /dev/null
+++ b/runs/ogbg-molbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..c263851
--- /dev/null
+++ b/runs/ogbg-molbace_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 17.2,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.6703296703296703
+  },
+  "test": {
+    "rocauc": 0.7242218744566161
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..dc748cb
--- /dev/null
+++ b/runs/ogbg-molbace_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 26.1,
+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7242218744566163
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..7d5f25d
--- /dev/null
+++ b/runs/ogbg-molbace_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 29.9,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rocauc": 0.702930402930403
+  },
+  "test": {
+    "rocauc": 0.7400452095287776
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4ed6321
--- /dev/null
+++ b/runs/ogbg-molbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..438332b
--- /dev/null
+++ b/runs/ogbg-molbace_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 11.5,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.638095238095238
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+  "test": {
+    "rocauc": 0.7393496783168144
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4d02789
--- /dev/null
+++ b/runs/ogbg-molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7732568249000173
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..13095ae
--- /dev/null
+++ b/runs/ogbg-molbace_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 13.8,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rocauc": 0.7128205128205128
+  },
+  "test": {
+    "rocauc": 0.7325682490001738
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..19b0e7a
--- /dev/null
+++ b/runs/ogbg-molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 17.5,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
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+  "test": {
+    "rocauc": 0.7449139280125194
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..c3a8f27
--- /dev/null
+++ b/runs/ogbg-molbace_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 22.0,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
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+  "test": {
+    "rocauc": 0.7336115458181186
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..f168f82
--- /dev/null
+++ b/runs/ogbg-molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "sec": 27.0,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.7169187967310032
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..358ccad
--- /dev/null
+++ b/runs/ogbg-molbace_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 12.1,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.7454355764214919
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..b9c0532
--- /dev/null
+++ b/runs/ogbg-molbace_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
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+  "hidden": 128,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..1ecb1b8
--- /dev/null
+++ b/runs/ogbg-molbace_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..38b40bc
--- /dev/null
+++ b/runs/ogbg-molbace_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 22.5,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.7461538461538462
+  },
+  "test": {
+    "rocauc": 0.7982959485306903
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..fbd4ded
--- /dev/null
+++ b/runs/ogbg-molbace_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 11.0,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.6758241758241759
+  },
+  "test": {
+    "rocauc": 0.7758650669448792
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..01d7a96
--- /dev/null
+++ b/runs/ogbg-molbace_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 16.6,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.6703296703296704
+  },
+  "test": {
+    "rocauc": 0.7118761954442706
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..0be66cb
--- /dev/null
+++ b/runs/ogbg-molbace_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 51.3,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rocauc": 0.7421245421245422
+  },
+  "test": {
+    "rocauc": 0.7760389497478699
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8667208
--- /dev/null
+++ b/runs/ogbg-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 52.6,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rocauc": 0.7234432234432234
+  },
+  "test": {
+    "rocauc": 0.7683881064162754
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..d12a0be
--- /dev/null
+++ b/runs/ogbg-molbace_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 30.2,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rocauc": 0.7516483516483518
+  },
+  "test": {
+    "rocauc": 0.6911841418883674
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..1ac26ac
--- /dev/null
+++ b/runs/ogbg-molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 29.3,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rocauc": 0.7036630036630036
+  },
+  "test": {
+    "rocauc": 0.7967310033037731
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..2789193
--- /dev/null
+++ b/runs/ogbg-molbace_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 21.1,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.7172161172161172
+  },
+  "test": {
+    "rocauc": 0.7876890975482524
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..cc03d1d
--- /dev/null
+++ b/runs/ogbg-molbace_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 22.7,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rocauc": 0.6912087912087912
+  },
+  "test": {
+    "rocauc": 0.7464788732394366
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..2749fcc
--- /dev/null
+++ b/runs/ogbg-molbace_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 13.6,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.6575091575091575
+  },
+  "test": {
+    "rocauc": 0.6965745087810815
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..387544f
--- /dev/null
+++ b/runs/ogbg-molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 23.0,
+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.772735176491045
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..e34b3b7
--- /dev/null
+++ b/runs/ogbg-molbace_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "sec": 16.0,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.7344809598330725
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..c399fa2
--- /dev/null
+++ b/runs/ogbg-molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.6805772909059293
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbace_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ef02f11
--- /dev/null
+++ b/runs/ogbg-molbace_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "metric": "rocauc",
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+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rocauc": 0.6663003663003664
+  },
+  "test": {
+    "rocauc": 0.7363936706659711
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbace_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbace_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4d9ce01
--- /dev/null
+++ b/runs/ogbg-molbace_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbace",
+  "tag": "ogbg-molbace_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 28.7,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rocauc": 0.6981684981684982
+  },
+  "test": {
+    "rocauc": 0.7487393496783169
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..e01c17a
--- /dev/null
+++ b/runs/ogbg-molbbbp_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 19.6,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.9146669321915762
+  },
+  "test": {
+    "rocauc": 0.6387924382716049
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..03928c0
--- /dev/null
+++ b/runs/ogbg-molbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 26.7,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.6073495370370371
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..d3696cf
--- /dev/null
+++ b/runs/ogbg-molbbbp_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 23.0,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
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+  "test": {
+    "rocauc": 0.6651234567901235
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..f14e5c2
--- /dev/null
+++ b/runs/ogbg-molbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 44.9,
+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.6634837962962963
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..c66161b
--- /dev/null
+++ b/runs/ogbg-molbbbp_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 19.6,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.9452354874041621
+  },
+  "test": {
+    "rocauc": 0.6514274691358024
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3b92e52
--- /dev/null
+++ b/runs/ogbg-molbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 27.4,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
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+  "test": {
+    "rocauc": 0.665895061728395
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..71cf8e4
--- /dev/null
+++ b/runs/ogbg-molbbbp_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 15.9,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.9285074181021606
+  },
+  "test": {
+    "rocauc": 0.6300154320987654
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..75350d8
--- /dev/null
+++ b/runs/ogbg-molbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.6323302469135803
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..c775266
--- /dev/null
+++ b/runs/ogbg-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.6324266975308642
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3c0370c
--- /dev/null
+++ b/runs/ogbg-molbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "hidden": 128,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a6a18df
--- /dev/null
+++ b/runs/ogbg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ba2c88e
--- /dev/null
+++ b/runs/ogbg-molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..96c4f79
--- /dev/null
+++ b/runs/ogbg-molbbbp_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..46346d4
--- /dev/null
+++ b/runs/ogbg-molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..6e9794f
--- /dev/null
+++ b/runs/ogbg-molbbbp_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
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+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4d3d022
--- /dev/null
+++ b/runs/ogbg-molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..d696564
--- /dev/null
+++ b/runs/ogbg-molbbbp_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7082f6c
--- /dev/null
+++ b/runs/ogbg-molbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..7883f62
--- /dev/null
+++ b/runs/ogbg-molbbbp_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
+  "agg_layers": 5,
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..5d5dc58
--- /dev/null
+++ b/runs/ogbg-molbbbp_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..b21c0b7
--- /dev/null
+++ b/runs/ogbg-molbbbp_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
+  "agg_layers": 5,
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..1a95b3f
--- /dev/null
+++ b/runs/ogbg-molbbbp_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..cd6c06d
--- /dev/null
+++ b/runs/ogbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
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+  "T": 0,
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+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..067dcf6
--- /dev/null
+++ b/runs/ogbg-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..04fb49d
--- /dev/null
+++ b/runs/ogbg-molbbbp_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..fd856dc
--- /dev/null
+++ b/runs/ogbg-molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 51.7,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.9584785422682465
+  },
+  "test": {
+    "rocauc": 0.6682098765432098
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..fdf12c1
--- /dev/null
+++ b/runs/ogbg-molbbbp_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 20.4,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.9182515184705764
+  },
+  "test": {
+    "rocauc": 0.6626157407407406
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..accc032
--- /dev/null
+++ b/runs/ogbg-molbbbp_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 40.2,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.9534999502140794
+  },
+  "test": {
+    "rocauc": 0.583912037037037
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..e1f6e85
--- /dev/null
+++ b/runs/ogbg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 15.1,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.9300009957184109
+  },
+  "test": {
+    "rocauc": 0.6239390432098766
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..256ff82
--- /dev/null
+++ b/runs/ogbg-molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 22.0,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.9285074181021606
+  },
+  "test": {
+    "rocauc": 0.6454475308641976
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..98c445b
--- /dev/null
+++ b/runs/ogbg-molbbbp_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 19.7,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.9476252115901622
+  },
+  "test": {
+    "rocauc": 0.6099537037037036
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..e80c891
--- /dev/null
+++ b/runs/ogbg-molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 30.0,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.9459324902917455
+  },
+  "test": {
+    "rocauc": 0.6419753086419753
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molbbbp_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..c83499c
--- /dev/null
+++ b/runs/ogbg-molbbbp_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 34.3,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.9495170765707458
+  },
+  "test": {
+    "rocauc": 0.6156442901234568
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molbbbp_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molbbbp_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a2dfef3
--- /dev/null
+++ b/runs/ogbg-molbbbp_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molbbbp",
+  "tag": "ogbg-molbbbp_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 36.9,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.9354774469779946
+  },
+  "test": {
+    "rocauc": 0.6221064814814815
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..fa5411b
--- /dev/null
+++ b/runs/ogbg-molclintox_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 16.0,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.8515931251846744
+  },
+  "test": {
+    "rocauc": 0.9184287352726515
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..e276b4d
--- /dev/null
+++ b/runs/ogbg-molclintox_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 30.3,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.9029408385042188
+  },
+  "test": {
+    "rocauc": 0.8898090223473396
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a9bdee1
--- /dev/null
+++ b/runs/ogbg-molclintox_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 19.3,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.9462941987589875
+  },
+  "test": {
+    "rocauc": 0.8678231327981094
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7488260
--- /dev/null
+++ b/runs/ogbg-molclintox_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 32.7,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.8863352796024051
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..d0d3745
--- /dev/null
+++ b/runs/ogbg-molclintox_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
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+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.9152165224342266
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7495809
--- /dev/null
+++ b/runs/ogbg-molclintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
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+  "hidden": 128,
+  "agg_layers": 5,
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+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4ba9e9c
--- /dev/null
+++ b/runs/ogbg-molclintox_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 23.7,
+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7730589441490285
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4eb4dec
--- /dev/null
+++ b/runs/ogbg-molclintox_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.8429647586278803
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..12a30aa
--- /dev/null
+++ b/runs/ogbg-molclintox_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..603df56
--- /dev/null
+++ b/runs/ogbg-molclintox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
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+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..acfb767
--- /dev/null
+++ b/runs/ogbg-molclintox_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 11.4,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.8932080422618427
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..b003dfe
--- /dev/null
+++ b/runs/ogbg-molclintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "hidden": 128,
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+  "halt_min_steps": 1,
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..297cd3e
--- /dev/null
+++ b/runs/ogbg-molclintox_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.8127689153025406
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..053b21b
--- /dev/null
+++ b/runs/ogbg-molclintox_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..13498e1
--- /dev/null
+++ b/runs/ogbg-molclintox_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
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+  "halt_target": "loss",
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+  "test": {
+    "rocauc": 0.8586383067459077
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..2eb5ad6
--- /dev/null
+++ b/runs/ogbg-molclintox_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..52546fb
--- /dev/null
+++ b/runs/ogbg-molclintox_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7876dc1
--- /dev/null
+++ b/runs/ogbg-molclintox_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..bd2e92c
--- /dev/null
+++ b/runs/ogbg-molclintox_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.850132937128558
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a57218f
--- /dev/null
+++ b/runs/ogbg-molclintox_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5eb0922
--- /dev/null
+++ b/runs/ogbg-molclintox_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 10.6,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.9143020125414492
+  },
+  "test": {
+    "rocauc": 0.8881694644284572
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..89cf219
--- /dev/null
+++ b/runs/ogbg-molclintox_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4574369
--- /dev/null
+++ b/runs/ogbg-molclintox_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 51.1,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
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+  "test": {
+    "rocauc": 0.8369808501025267
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4bb8f7a
--- /dev/null
+++ b/runs/ogbg-molclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..3a82461
--- /dev/null
+++ b/runs/ogbg-molclintox_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.8602891599763668
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..67f69a4
--- /dev/null
+++ b/runs/ogbg-molclintox_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.8734968546901609
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4256fd6
--- /dev/null
+++ b/runs/ogbg-molclintox_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
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+  "hidden": 128,
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+  "halt_target": "loss",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.9184252597921663
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..480b881
--- /dev/null
+++ b/runs/ogbg-molclintox_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "hidden": 128,
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+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..47d3ae9
--- /dev/null
+++ b/runs/ogbg-molclintox_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..038547d
--- /dev/null
+++ b/runs/ogbg-molclintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
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+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..aa7648f
--- /dev/null
+++ b/runs/ogbg-molclintox_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 23.4,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.923656390557799
+  },
+  "test": {
+    "rocauc": 0.7998149306641643
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4a0238f
--- /dev/null
+++ b/runs/ogbg-molclintox_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 30.9,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.9182762073607145
+  },
+  "test": {
+    "rocauc": 0.8432784207416675
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molclintox_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..605855f
--- /dev/null
+++ b/runs/ogbg-molclintox_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 29.2,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.9270511178961884
+  },
+  "test": {
+    "rocauc": 0.8763771591422514
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molclintox_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molclintox_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..50ba6e4
--- /dev/null
+++ b/runs/ogbg-molclintox_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molclintox",
+  "tag": "ogbg-molclintox_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 38.6,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.9321957385337667
+  },
+  "test": {
+    "rocauc": 0.8521686998227505
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..6a47cc6
--- /dev/null
+++ b/runs/ogbg-molesol_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.3,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 1.608295202255249
+  },
+  "test": {
+    "rmse": 1.5212217569351196
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..719533d
--- /dev/null
+++ b/runs/ogbg-molesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 17.4,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 1.4195600748062134
+  },
+  "test": {
+    "rmse": 1.4928637742996216
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..7ce93b8
--- /dev/null
+++ b/runs/ogbg-molesol_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.5,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 1.0194642543792725
+  },
+  "test": {
+    "rmse": 1.0665998458862305
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..5beccfd
--- /dev/null
+++ b/runs/ogbg-molesol_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 17.6,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 1.003442406654358
+  },
+  "test": {
+    "rmse": 1.1272348165512085
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..30b1a7a
--- /dev/null
+++ b/runs/ogbg-molesol_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 10.8,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rmse": 0.9649985432624817
+  },
+  "test": {
+    "rmse": 0.8722475171089172
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ce5887e
--- /dev/null
+++ b/runs/ogbg-molesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 14.6,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 0.9198977947235107
+  },
+  "test": {
+    "rmse": 0.8840651512145996
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..db08bfe
--- /dev/null
+++ b/runs/ogbg-molesol_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 9.3,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 1.0717737674713135
+  },
+  "test": {
+    "rmse": 1.2896088361740112
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..f4729c2
--- /dev/null
+++ b/runs/ogbg-molesol_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 14.6,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 1.0196408033370972
+  },
+  "test": {
+    "rmse": 1.084921956062317
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5fab56a
--- /dev/null
+++ b/runs/ogbg-molesol_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 16.1,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 1.0367836952209473
+  },
+  "test": {
+    "rmse": 0.9878302216529846
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ab55e2b
--- /dev/null
+++ b/runs/ogbg-molesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
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+  "test": {
+    "rmse": 0.9779817461967468
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..8498f5c
--- /dev/null
+++ b/runs/ogbg-molesol_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 7.7,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 1.0408910512924194
+  },
+  "test": {
+    "rmse": 1.1161426305770874
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..c279b31
--- /dev/null
+++ b/runs/ogbg-molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.3,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.9590842127799988
+  },
+  "test": {
+    "rmse": 0.9305291175842285
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..8598a27
--- /dev/null
+++ b/runs/ogbg-molesol_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 9.5,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 1.0088852643966675
+  },
+  "test": {
+    "rmse": 0.8762271404266357
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ac5af1b
--- /dev/null
+++ b/runs/ogbg-molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 15.9,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 1.0026726722717285
+  },
+  "test": {
+    "rmse": 0.920613169670105
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..3656879
--- /dev/null
+++ b/runs/ogbg-molesol_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 8.7,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rmse": 1.0186669826507568
+  },
+  "test": {
+    "rmse": 0.9899855852127075
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..24aa419
--- /dev/null
+++ b/runs/ogbg-molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 14.8,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.9646593928337097
+  },
+  "test": {
+    "rmse": 1.0798395872116089
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..71039a3
--- /dev/null
+++ b/runs/ogbg-molesol_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 13.2,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 1.0286154747009277
+  },
+  "test": {
+    "rmse": 1.0806611776351929
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3eb0ea1
--- /dev/null
+++ b/runs/ogbg-molesol_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 13.6,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 1.0580767393112183
+  },
+  "test": {
+    "rmse": 1.0950747728347778
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..247fa49
--- /dev/null
+++ b/runs/ogbg-molesol_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 7.0,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.9740990400314331
+  },
+  "test": {
+    "rmse": 0.9732325673103333
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ece0df6
--- /dev/null
+++ b/runs/ogbg-molesol_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 10.7,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 1.0048154592514038
+  },
+  "test": {
+    "rmse": 0.9968388080596924
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a2f7308
--- /dev/null
+++ b/runs/ogbg-molesol_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 7.1,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.9680215120315552
+  },
+  "test": {
+    "rmse": 1.0037521123886108
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..de80ece
--- /dev/null
+++ b/runs/ogbg-molesol_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.6,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rmse": 0.9934180974960327
+  },
+  "test": {
+    "rmse": 1.0794438123703003
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ebb24ff
--- /dev/null
+++ b/runs/ogbg-molesol_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 22.8,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
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+  "test": {
+    "rmse": 1.0638543367385864
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a46243a
--- /dev/null
+++ b/runs/ogbg-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 41.5,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 1.055277943611145
+  },
+  "test": {
+    "rmse": 1.0367581844329834
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..c49f0b7
--- /dev/null
+++ b/runs/ogbg-molesol_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 18.9,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.911565363407135
+  },
+  "test": {
+    "rmse": 0.9152661561965942
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..53395fa
--- /dev/null
+++ b/runs/ogbg-molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 25.1,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 0.9840529561042786
+  },
+  "test": {
+    "rmse": 0.9092428088188171
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ffa3eaf
--- /dev/null
+++ b/runs/ogbg-molesol_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 9.9,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rmse": 0.9491544961929321
+  },
+  "test": {
+    "rmse": 0.8908001780509949
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..626ef87
--- /dev/null
+++ b/runs/ogbg-molesol_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 24.6,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.9873355627059937
+  },
+  "test": {
+    "rmse": 0.8825017213821411
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5fcc1d3
--- /dev/null
+++ b/runs/ogbg-molesol_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 9.6,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 1.061699628829956
+  },
+  "test": {
+    "rmse": 0.9779573082923889
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..6c40242
--- /dev/null
+++ b/runs/ogbg-molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.6,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 1.0129139423370361
+  },
+  "test": {
+    "rmse": 0.9372893571853638
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..bdab4c4
--- /dev/null
+++ b/runs/ogbg-molesol_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 10.5,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rmse": 0.9323490858078003
+  },
+  "test": {
+    "rmse": 0.9677547216415405
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..317fb16
--- /dev/null
+++ b/runs/ogbg-molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 16.3,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 0.9035957455635071
+  },
+  "test": {
+    "rmse": 0.9462130665779114
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molesol_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ff4f947
--- /dev/null
+++ b/runs/ogbg-molesol_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.8,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rmse": 0.9397740960121155
+  },
+  "test": {
+    "rmse": 0.9491862058639526
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molesol_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molesol_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..31a2397
--- /dev/null
+++ b/runs/ogbg-molesol_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molesol",
+  "tag": "ogbg-molesol_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 24.7,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rmse": 1.0003974437713623
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..746e804
--- /dev/null
+++ b/runs/ogbg-molfreesolv_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 6.7,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rmse": 6.046187400817871
+  },
+  "test": {
+    "rmse": 4.647761821746826
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..11c5a38
--- /dev/null
+++ b/runs/ogbg-molfreesolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
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+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rmse": 5.559294700622559
+  },
+  "test": {
+    "rmse": 3.654918670654297
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..472f3ab
--- /dev/null
+++ b/runs/ogbg-molfreesolv_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.1,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rmse": 4.26617956161499
+  },
+  "test": {
+    "rmse": 2.9769132137298584
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..72a427a
--- /dev/null
+++ b/runs/ogbg-molfreesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 16.4,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rmse": 5.068253993988037
+  },
+  "test": {
+    "rmse": 3.6822547912597656
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5613bf2
--- /dev/null
+++ b/runs/ogbg-molfreesolv_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 6.6,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 2.9480721950531006
+  },
+  "test": {
+    "rmse": 2.2430641651153564
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..864eff5
--- /dev/null
+++ b/runs/ogbg-molfreesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 8.9,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 3.0142416954040527
+  },
+  "test": {
+    "rmse": 2.2398786544799805
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..13f4682
--- /dev/null
+++ b/runs/ogbg-molfreesolv_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 5.9,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rmse": 3.1545956134796143
+  },
+  "test": {
+    "rmse": 2.9581117630004883
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8371249
--- /dev/null
+++ b/runs/ogbg-molfreesolv_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 13.1,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rmse": 3.2952098846435547
+  },
+  "test": {
+    "rmse": 3.304159164428711
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a1f6fad
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 10.3,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 4.208639144897461
+  },
+  "test": {
+    "rmse": 2.7368204593658447
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..84f9f46
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 13.0,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 3.9983770847320557
+  },
+  "test": {
+    "rmse": 2.5965566635131836
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..8553aee
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 4.7,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 3.7172489166259766
+  },
+  "test": {
+    "rmse": 2.4850735664367676
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..06a4ed7
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 7.1,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rmse": 3.5887632369995117
+  },
+  "test": {
+    "rmse": 2.4443516731262207
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a0ef0ee
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 5.8,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 3.9998085498809814
+  },
+  "test": {
+    "rmse": 2.558762788772583
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..9c5f0a0
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.4,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 4.300873279571533
+  },
+  "test": {
+    "rmse": 2.9063339233398438
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..e1db15f
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 4.9,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 4.018989086151123
+  },
+  "test": {
+    "rmse": 3.4898324012756348
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..1f527f0
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "sec": 12.1,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rmse": 3.4291605949401855
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..21a7f6a
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 5.0,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rmse": 3.296074151992798
+  },
+  "test": {
+    "rmse": 3.144200086593628
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..20e37b9
--- /dev/null
+++ b/runs/ogbg-molfreesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 11.5,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 4.446825981140137
+  },
+  "test": {
+    "rmse": 3.740544319152832
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..fecde17
--- /dev/null
+++ b/runs/ogbg-molfreesolv_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 4.2,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rmse": 2.5313968658447266
+  },
+  "test": {
+    "rmse": 2.7952840328216553
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ead7559
--- /dev/null
+++ b/runs/ogbg-molfreesolv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 7.2,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 2.9106228351593018
+  },
+  "test": {
+    "rmse": 3.142881155014038
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4f2daf7
--- /dev/null
+++ b/runs/ogbg-molfreesolv_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 4.4,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 3.5022244453430176
+  },
+  "test": {
+    "rmse": 2.2976508140563965
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7aa2f03
--- /dev/null
+++ b/runs/ogbg-molfreesolv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 6.9,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rmse": 3.7380001544952393
+  },
+  "test": {
+    "rmse": 2.193081855773926
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a5b647c
--- /dev/null
+++ b/runs/ogbg-molfreesolv_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 24.2,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rmse": 2.737367630004883
+  },
+  "test": {
+    "rmse": 2.8884994983673096
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..29a8bef
--- /dev/null
+++ b/runs/ogbg-molfreesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 24.8,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 2.5060386657714844
+  },
+  "test": {
+    "rmse": 3.1891541481018066
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..81ea6ec
--- /dev/null
+++ b/runs/ogbg-molfreesolv_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 13.6,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 2.3625338077545166
+  },
+  "test": {
+    "rmse": 2.2610387802124023
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..de0fee4
--- /dev/null
+++ b/runs/ogbg-molfreesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 16.4,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 3.3333704471588135
+  },
+  "test": {
+    "rmse": 2.4279491901397705
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..9187a7a
--- /dev/null
+++ b/runs/ogbg-molfreesolv_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 8.1,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 2.4772303104400635
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+  "test": {
+    "rmse": 2.0041325092315674
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7efe491
--- /dev/null
+++ b/runs/ogbg-molfreesolv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "epochs": 100,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rmse": 2.0244016647338867
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..08ba938
--- /dev/null
+++ b/runs/ogbg-molfreesolv_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 5.0,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
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+  "test": {
+    "rmse": 2.4146173000335693
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..d6ec5dc
--- /dev/null
+++ b/runs/ogbg-molfreesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 7.4,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 3.9261200428009033
+  },
+  "test": {
+    "rmse": 2.4886999130249023
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..1d73b02
--- /dev/null
+++ b/runs/ogbg-molfreesolv_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 6.7,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rmse": 2.687361001968384
+  },
+  "test": {
+    "rmse": 2.3825674057006836
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ab5daea
--- /dev/null
+++ b/runs/ogbg-molfreesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 9.9,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rmse": 2.735919952392578
+  },
+  "test": {
+    "rmse": 2.0588314533233643
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molfreesolv_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..7842d4a
--- /dev/null
+++ b/runs/ogbg-molfreesolv_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 8.5,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rmse": 4.094240665435791
+  },
+  "test": {
+    "rmse": 2.3205413818359375
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molfreesolv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molfreesolv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ad17542
--- /dev/null
+++ b/runs/ogbg-molfreesolv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molfreesolv",
+  "tag": "ogbg-molfreesolv_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 10.4,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rmse": 4.417959690093994
+  },
+  "test": {
+    "rmse": 2.432546377182007
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..96c1ef5
--- /dev/null
+++ b/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s1",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 1,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 474.4,
+  "dev": "cuda:0",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.6934707524985303
+  },
+  "test": {
+    "rocauc": 0.7044149172444427
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..0f7a3cf
--- /dev/null
+++ b/runs/ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_appnp_classic_T0_ns1_h128_e100_s2",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 2,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 479.4,
+  "dev": "cuda:0",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.7213342641583382
+  },
+  "test": {
+    "rocauc": 0.690191004075011
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..f0c1da1
--- /dev/null
+++ b/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 802.7,
+  "dev": "cuda:0",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.7573179992161474
+  },
+  "test": {
+    "rocauc": 0.7228548253152822
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..c5de3ef
--- /dev/null
+++ b/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 925.6,
+  "dev": "cuda:0",
+  "ep": 60,
+  "val": {
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+  "test": {
+    "rocauc": 0.7448212595840012
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..ff308ee
--- /dev/null
+++ b/runs/ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_appnp_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 2,
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+  "max_eval_batches": 0,
+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 793.0,
+  "dev": "cuda:0",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.7619568146188516
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+  "test": {
+    "rocauc": 0.72329708955368
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..f68ee33
--- /dev/null
+++ b/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s1",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 1,
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+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 872.0,
+  "dev": "cuda:0",
+  "ep": 50,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7197338689430077
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..fa28286
--- /dev/null
+++ b/runs/ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_arma_classic_T0_ns1_h128_e100_s2",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "epochs": 100,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:0",
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+  "dev": "cuda:0",
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+  "test": {
+    "rocauc": 0.7694818362656676
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..0580718
--- /dev/null
+++ b/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "halt_max_steps": 8,
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+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..0bf9e9d
--- /dev/null
+++ b/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "hidden": 128,
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..304dd63
--- /dev/null
+++ b/runs/ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_arma_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "arma",
+  "compute": "fixed-rrog",
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+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "val": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..c8c48a9
--- /dev/null
+++ b/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s1",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "val": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..25f58ff
--- /dev/null
+++ b/runs/ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_cheb_classic_T0_ns1_h128_e100_s2",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4d6939c
--- /dev/null
+++ b/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..e4e897e
--- /dev/null
+++ b/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "cheb",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..62dc770
--- /dev/null
+++ b/runs/ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_cheb_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "cheb",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..8e0aa76
--- /dev/null
+++ b/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_film_classic_T0_ns1_h128_e100_s1",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..0e4ea69
--- /dev/null
+++ b/runs/ogbg-molhiv_film_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_film_classic_T0_ns1_h128_e100_s2",
+  "view": "film",
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+  "T": 0,
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a874862
--- /dev/null
+++ b/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..95b90c4
--- /dev/null
+++ b/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "film",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..2af945e
--- /dev/null
+++ b/runs/ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_film_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "film",
+  "compute": "fixed-rrog",
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+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..1c65b7a
--- /dev/null
+++ b/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s1",
+  "view": "gatv2",
+  "compute": "classic",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..73c6073
--- /dev/null
+++ b/runs/ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gatv2_classic_T0_ns1_h128_e100_s2",
+  "view": "gatv2",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..e62c1ef
--- /dev/null
+++ b/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..4351ea8
--- /dev/null
+++ b/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "gatv2",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..f276429
--- /dev/null
+++ b/runs/ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gatv2_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..3b56de3
--- /dev/null
+++ b/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s1",
+  "view": "gcn",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..465a3b3
--- /dev/null
+++ b/runs/ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gcn_classic_T0_ns1_h128_e100_s2",
+  "view": "gcn",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ea60520
--- /dev/null
+++ b/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..a731208
--- /dev/null
+++ b/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "gcn",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..c625a4c
--- /dev/null
+++ b/runs/ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gcn_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "gcn",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..6917858
--- /dev/null
+++ b/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s1",
+  "view": "gen",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..7b0261b
--- /dev/null
+++ b/runs/ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gen_classic_T0_ns1_h128_e100_s2",
+  "view": "gen",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..520759b
--- /dev/null
+++ b/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..533c8bf
--- /dev/null
+++ b/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "gen",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..ebb7a88
--- /dev/null
+++ b/runs/ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gen_fixed-rrog_T1_ns3_h128_e100_s2",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..a3016cb
--- /dev/null
+++ b/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
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+  "tag": "ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..1441a04
--- /dev/null
+++ b/runs/ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gin_classic_T0_ns1_h128_e100_s2",
+  "view": "gin",
+  "compute": "classic",
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+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a5da14d
--- /dev/null
+++ b/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
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+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..fe35c37
--- /dev/null
+++ b/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "gin",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..b9cba39
--- /dev/null
+++ b/runs/ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gin_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "gin",
+  "compute": "fixed-rrog",
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+  "n_sup": 3,
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..d88283d
--- /dev/null
+++ b/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s1",
+  "view": "gine",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..9f1f6de
--- /dev/null
+++ b/runs/ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gine_classic_T0_ns1_h128_e100_s2",
+  "view": "gine",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..6bfee5b
--- /dev/null
+++ b/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..3f9fb8a
--- /dev/null
+++ b/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "gine",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..2c42092
--- /dev/null
+++ b/runs/ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_gine_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "gine",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..d2362dd
--- /dev/null
+++ b/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s1",
+  "view": "graphconv",
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+  "T": 0,
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+  "hidden": 128,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..c49b184
--- /dev/null
+++ b/runs/ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphconv_classic_T0_ns1_h128_e100_s2",
+  "view": "graphconv",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..9cf349f
--- /dev/null
+++ b/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..ae03725
--- /dev/null
+++ b/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "graphconv",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..a338cbd
--- /dev/null
+++ b/runs/ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphconv_fixed-rrog_T1_ns3_h128_e100_s2",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..43bf748
--- /dev/null
+++ b/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..9ccf7e4
--- /dev/null
+++ b/runs/ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphsage_classic_T0_ns1_h128_e100_s2",
+  "view": "graphsage",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3f9f5d9
--- /dev/null
+++ b/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..f8b906b
--- /dev/null
+++ b/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..c0bc09c
--- /dev/null
+++ b/runs/ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_graphsage_fixed-rrog_T1_ns3_h128_e100_s2",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..45239b6
--- /dev/null
+++ b/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..0a54ab0
--- /dev/null
+++ b/runs/ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_mf_classic_T0_ns1_h128_e100_s2",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a4a8bc9
--- /dev/null
+++ b/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s0",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..e0f745e
--- /dev/null
+++ b/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..bbce3ca
--- /dev/null
+++ b/runs/ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_mf_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "mf",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..2918d26
--- /dev/null
+++ b/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s1",
+  "view": "pna",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..8ad1de4
--- /dev/null
+++ b/runs/ogbg-molhiv_pna_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..d37c7d3
--- /dev/null
+++ b/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s0",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..e5b3dd1
--- /dev/null
+++ b/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "pna",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..19f20d0
--- /dev/null
+++ b/runs/ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_pna_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "pna",
+  "compute": "fixed-rrog",
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+  "hidden": 128,
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..260a7dc
--- /dev/null
+++ b/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s1",
+  "view": "resgated",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..2bc4a4f
--- /dev/null
+++ b/runs/ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_resgated_classic_T0_ns1_h128_e100_s2",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..73a87a9
--- /dev/null
+++ b/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..b31ca8b
--- /dev/null
+++ b/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..aabf825
--- /dev/null
+++ b/runs/ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_resgated_fixed-rrog_T1_ns3_h128_e100_s2",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..0375109
--- /dev/null
+++ b/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..c8af7ef
--- /dev/null
+++ b/runs/ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_sgc_classic_T0_ns1_h128_e100_s2",
+  "view": "sgc",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..6113561
--- /dev/null
+++ b/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..de5740d
--- /dev/null
+++ b/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s1",
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\ No newline at end of file
diff --git a/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..51be4d8
--- /dev/null
+++ b/runs/ogbg-molhiv_sgc_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
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+    "rocauc": 0.7665741965510485
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+    "rocauc": 0.7427122964908555
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..bf5a55b
--- /dev/null
+++ b/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s1",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 1,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 616.8,
+  "dev": "cuda:0",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7487765310260917
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..b9406c3
--- /dev/null
+++ b/runs/ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_tag_classic_T0_ns1_h128_e100_s2",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 2,
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+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 658.9,
+  "dev": "cuda:0",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ea17c1a
--- /dev/null
+++ b/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "metric": "rocauc",
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+  "dev": "cuda:0",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7181154522103554
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..e132ac4
--- /dev/null
+++ b/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:0",
+  "metric": "rocauc",
+  "sec": 884.1,
+  "dev": "cuda:0",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..aad79c1
--- /dev/null
+++ b/runs/ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_tag_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:0",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7545375538345662
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s1.json b/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s1.json
new file mode 100644
index 0000000..4d0b540
--- /dev/null
+++ b/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s1",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "sec": 917.2,
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+  "val": {
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+  "test": {
+    "rocauc": 0.7883891152783947
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s2.json b/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s2.json
new file mode 100644
index 0000000..84cf314
--- /dev/null
+++ b/runs/ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_transformer_classic_T0_ns1_h128_e100_s2",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  },
+  "test": {
+    "rocauc": 0.7711736418239055
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..9fcb322
--- /dev/null
+++ b/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:0",
+  "metric": "rocauc",
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+  "dev": "cuda:0",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.7838158926121889
+  },
+  "test": {
+    "rocauc": 0.7647501883002762
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s1.json b/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s1.json
new file mode 100644
index 0000000..4961b21
--- /dev/null
+++ b/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s1.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s1",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "hidden": 128,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:0",
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+  "test": {
+    "rocauc": 0.749757623747079
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s2.json b/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s2.json
new file mode 100644
index 0000000..1bb42aa
--- /dev/null
+++ b/runs/ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s2.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molhiv",
+  "tag": "ogbg-molhiv_transformer_fixed-rrog_T1_ns3_h128_e100_s2",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "epochs": 100,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..76b378b
--- /dev/null
+++ b/runs/ogbg-mollipo_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 43.5,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 0.9014809727668762
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+  "test": {
+    "rmse": 0.9070075154304504
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..b9f9086
--- /dev/null
+++ b/runs/ogbg-mollipo_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "val": {
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+  "test": {
+    "rmse": 0.9173930287361145
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..dac8f21
--- /dev/null
+++ b/runs/ogbg-mollipo_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "halt_exploration_prob": 0.1,
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+  "sec": 67.1,
+  "dev": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..b2c75d3
--- /dev/null
+++ b/runs/ogbg-mollipo_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 98.7,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 0.7172609567642212
+  },
+  "test": {
+    "rmse": 0.7547623515129089
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..fbbe6be
--- /dev/null
+++ b/runs/ogbg-mollipo_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 41.9,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.7188113927841187
+  },
+  "test": {
+    "rmse": 0.7179734706878662
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..5eba1b4
--- /dev/null
+++ b/runs/ogbg-mollipo_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 66.9,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.6990480422973633
+  },
+  "test": {
+    "rmse": 0.7132058143615723
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..1488ae4
--- /dev/null
+++ b/runs/ogbg-mollipo_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 52.4,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 0.7620365619659424
+  },
+  "test": {
+    "rmse": 0.7370873689651489
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8cf3938
--- /dev/null
+++ b/runs/ogbg-mollipo_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 85.7,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.8122015595436096
+  },
+  "test": {
+    "rmse": 0.7353013753890991
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a1373e9
--- /dev/null
+++ b/runs/ogbg-mollipo_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 70.6,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rmse": 0.6864758729934692
+  },
+  "test": {
+    "rmse": 0.7307590842247009
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..14353de
--- /dev/null
+++ b/runs/ogbg-mollipo_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
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+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 115.7,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.7079874277114868
+  },
+  "test": {
+    "rmse": 0.733400285243988
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a639220
--- /dev/null
+++ b/runs/ogbg-mollipo_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 32.4,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.7378985285758972
+  },
+  "test": {
+    "rmse": 0.782814621925354
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..625b0a6
--- /dev/null
+++ b/runs/ogbg-mollipo_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
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+  "sec": 46.3,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rmse": 0.773021936416626
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+  "test": {
+    "rmse": 0.7758824825286865
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..8f45cbc
--- /dev/null
+++ b/runs/ogbg-mollipo_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
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+  "sec": 60.8,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rmse": 0.7046297788619995
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+  "test": {
+    "rmse": 0.7378753423690796
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..bb1fc48
--- /dev/null
+++ b/runs/ogbg-mollipo_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 77.5,
+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rmse": 0.7455868124961853
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..254e616
--- /dev/null
+++ b/runs/ogbg-mollipo_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
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+  "sec": 56.5,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rmse": 0.7389819622039795
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..b09bc85
--- /dev/null
+++ b/runs/ogbg-mollipo_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..91316a4
--- /dev/null
+++ b/runs/ogbg-mollipo_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
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+  "metric": "rmse",
+  "sec": 63.4,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
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+  },
+  "test": {
+    "rmse": 0.7341321706771851
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..47fb60b
--- /dev/null
+++ b/runs/ogbg-mollipo_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 74.6,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.7167647480964661
+  },
+  "test": {
+    "rmse": 0.731584906578064
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..3056f46
--- /dev/null
+++ b/runs/ogbg-mollipo_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 42.0,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
+    "rmse": 0.7177638411521912
+  },
+  "test": {
+    "rmse": 0.729673445224762
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8691e5a
--- /dev/null
+++ b/runs/ogbg-mollipo_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 79.8,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
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+  },
+  "test": {
+    "rmse": 0.7395755052566528
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4ccb844
--- /dev/null
+++ b/runs/ogbg-mollipo_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 41.2,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.7239025831222534
+  },
+  "test": {
+    "rmse": 0.7783035635948181
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3c63ef7
--- /dev/null
+++ b/runs/ogbg-mollipo_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 66.9,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ad2b2d7
--- /dev/null
+++ b/runs/ogbg-mollipo_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 113.2,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rmse": 0.712922215461731
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+  "test": {
+    "rmse": 0.7404878735542297
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a781542
--- /dev/null
+++ b/runs/ogbg-mollipo_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 129.1,
+  "dev": "cuda:1",
+  "ep": 100,
+  "val": {
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+  "test": {
+    "rmse": 0.710095226764679
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ec34057
--- /dev/null
+++ b/runs/ogbg-mollipo_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 92.1,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
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+  "test": {
+    "rmse": 0.7749425172805786
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..7173b7c
--- /dev/null
+++ b/runs/ogbg-mollipo_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5493265
--- /dev/null
+++ b/runs/ogbg-mollipo_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rmse": 0.7270413041114807
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..27e4416
--- /dev/null
+++ b/runs/ogbg-mollipo_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4c4c616
--- /dev/null
+++ b/runs/ogbg-mollipo_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..1648b69
--- /dev/null
+++ b/runs/ogbg-mollipo_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
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+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 72.1,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.7536844611167908
+  },
+  "test": {
+    "rmse": 0.7490182518959045
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..90c373d
--- /dev/null
+++ b/runs/ogbg-mollipo_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 43.9,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.6691507697105408
+  },
+  "test": {
+    "rmse": 0.7226714491844177
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..711ec49
--- /dev/null
+++ b/runs/ogbg-mollipo_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 86.6,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.6743124723434448
+  },
+  "test": {
+    "rmse": 0.7200686931610107
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-mollipo_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ece8648
--- /dev/null
+++ b/runs/ogbg-mollipo_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 78.7,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rmse": 0.6809519529342651
+  },
+  "test": {
+    "rmse": 0.7346181273460388
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-mollipo_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-mollipo_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..6d1cd1f
--- /dev/null
+++ b/runs/ogbg-mollipo_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-mollipo",
+  "tag": "ogbg-mollipo_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rmse",
+  "sec": 74.7,
+  "dev": "cuda:1",
+  "ep": 90,
+  "val": {
+    "rmse": 0.6688172817230225
+  },
+  "test": {
+    "rmse": 0.7396050095558167
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..368fdba
--- /dev/null
+++ b/runs/ogbg-molsider_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 14.7,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rocauc": 0.5886184927786781
+  },
+  "test": {
+    "rocauc": 0.6003864841212386
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..bfcac49
--- /dev/null
+++ b/runs/ogbg-molsider_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 18.6,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.5937589012949048
+  },
+  "test": {
+    "rocauc": 0.5905116380584287
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..082b9ed
--- /dev/null
+++ b/runs/ogbg-molsider_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 16.0,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
+    "rocauc": 0.627268343131736
+  },
+  "test": {
+    "rocauc": 0.6158698228431547
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8ba623d
--- /dev/null
+++ b/runs/ogbg-molsider_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 27.1,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
+    "rocauc": 0.634361816858312
+  },
+  "test": {
+    "rocauc": 0.6140829013811058
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ff70dc1
--- /dev/null
+++ b/runs/ogbg-molsider_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 14.1,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.6237482002412537
+  },
+  "test": {
+    "rocauc": 0.6033376509930031
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..9f33571
--- /dev/null
+++ b/runs/ogbg-molsider_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 18.3,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.626299014853098
+  },
+  "test": {
+    "rocauc": 0.609583177772403
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..710fa5c
--- /dev/null
+++ b/runs/ogbg-molsider_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 12.6,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.6024369569728498
+  },
+  "test": {
+    "rocauc": 0.5898473664808705
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3354a5b
--- /dev/null
+++ b/runs/ogbg-molsider_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 23.5,
+  "dev": "cuda:1",
+  "ep": 80,
+  "val": {
+    "rocauc": 0.5862480936504801
+  },
+  "test": {
+    "rocauc": 0.5974246609585021
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ddbf7c3
--- /dev/null
+++ b/runs/ogbg-molsider_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 21.3,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.6071193037623003
+  },
+  "test": {
+    "rocauc": 0.6013146804327355
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..260596d
--- /dev/null
+++ b/runs/ogbg-molsider_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
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+  "halt_target": "loss",
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.6000090607166413
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..6c59b26
--- /dev/null
+++ b/runs/ogbg-molsider_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 11.7,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.6292912980815916
+  },
+  "test": {
+    "rocauc": 0.6086409341357526
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8d3e9b4
--- /dev/null
+++ b/runs/ogbg-molsider_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.6117391432513807
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..12ae0cb
--- /dev/null
+++ b/runs/ogbg-molsider_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 15.4,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.6519400080762945
+  },
+  "test": {
+    "rocauc": 0.5853709823208472
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..72b6125
--- /dev/null
+++ b/runs/ogbg-molsider_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.6052572461025753
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..b981888
--- /dev/null
+++ b/runs/ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 19.4,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
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+  "test": {
+    "rocauc": 0.5748427490288601
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..467f5eb
--- /dev/null
+++ b/runs/ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 27.3,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.6022262654061706
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..d103d31
--- /dev/null
+++ b/runs/ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 18.0,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
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+  "test": {
+    "rocauc": 0.5494595931506057
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..b344579
--- /dev/null
+++ b/runs/ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 27.1,
+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.6150033205476824
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..fb39a85
--- /dev/null
+++ b/runs/ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "sec": 10.5,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
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+  "test": {
+    "rocauc": 0.6151152605717433
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a06fefa
--- /dev/null
+++ b/runs/ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..67f10a7
--- /dev/null
+++ b/runs/ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "test": {
+    "rocauc": 0.5807259430259354
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..2edaf8f
--- /dev/null
+++ b/runs/ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..8d860a9
--- /dev/null
+++ b/runs/ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "q_warmup_epochs": 0,
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+  "num_workers": 0,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 44.5,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.586091595334005
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..e4006b4
--- /dev/null
+++ b/runs/ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 49.3,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.6189914567323086
+  },
+  "test": {
+    "rocauc": 0.598312638550014
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ccb8fdd
--- /dev/null
+++ b/runs/ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 30.5,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.6218537848171463
+  },
+  "test": {
+    "rocauc": 0.5964761418261523
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..c94cfbf
--- /dev/null
+++ b/runs/ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 27.1,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.6057840094519997
+  },
+  "test": {
+    "rocauc": 0.5721280929989979
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..400fd8d
--- /dev/null
+++ b/runs/ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 23.5,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.6209450264359846
+  },
+  "test": {
+    "rocauc": 0.5910349402024013
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..bc7861b
--- /dev/null
+++ b/runs/ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 28.0,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.5960257361986486
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..1ce0296
--- /dev/null
+++ b/runs/ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 12.2,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.6173711459877224
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+  "test": {
+    "rocauc": 0.6042590538050838
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..e656a13
--- /dev/null
+++ b/runs/ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 15.3,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.6151272572948054
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+  "test": {
+    "rocauc": 0.6417135077812745
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..eb6b8b5
--- /dev/null
+++ b/runs/ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 17.7,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.6438543175768482
+  },
+  "test": {
+    "rocauc": 0.6143146363395369
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..84cef00
--- /dev/null
+++ b/runs/ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "val": {
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+  "test": {
+    "rocauc": 0.6101942928754263
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..2a3c823
--- /dev/null
+++ b/runs/ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.5979944408282211
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+}
\ No newline at end of file
diff --git a/runs/ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..53c8c7b
--- /dev/null
+++ b/runs/ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-molsider",
+  "tag": "ogbg-molsider_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "test": {
+    "rocauc": 0.6190391448308609
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..e67e2be
--- /dev/null
+++ b/runs/ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_appnp_classic_T0_ns1_h128_e100_s0",
+  "view": "appnp",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
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+  "halt_min_steps": 1,
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..f86a36c
--- /dev/null
+++ b/runs/ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_appnp_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "appnp",
+  "compute": "fixed-rrog",
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+  "val": {
+    "rocauc": 0.7279951275996247
+  },
+  "test": {
+    "rocauc": 0.7153555287245948
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..1ee54ec
--- /dev/null
+++ b/runs/ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_arma_classic_T0_ns1_h128_e100_s0",
+  "view": "arma",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 91.6,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
+    "rocauc": 0.7798972501326612
+  },
+  "test": {
+    "rocauc": 0.7222812510383411
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..3f4c8e0
--- /dev/null
+++ b/runs/ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_arma_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "arma",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "seed": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 166.1,
+  "dev": "cuda:1",
+  "ep": 60,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7208970968150412
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..12898a7
--- /dev/null
+++ b/runs/ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_cheb_classic_T0_ns1_h128_e100_s0",
+  "view": "cheb",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "num_workers": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 69.4,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.7834436091147085
+  },
+  "test": {
+    "rocauc": 0.7300685430388674
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..d3d5445
--- /dev/null
+++ b/runs/ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_cheb_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "cheb",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
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+  },
+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4578ed2
--- /dev/null
+++ b/runs/ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_film_classic_T0_ns1_h128_e100_s0",
+  "view": "film",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 66.4,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.7701993310949509
+  },
+  "test": {
+    "rocauc": 0.7160313530552065
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..8867da4
--- /dev/null
+++ b/runs/ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_film_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "film",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7369411241728653
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5061166
--- /dev/null
+++ b/runs/ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gatv2_classic_T0_ns1_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 147.3,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7159809011324226
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..6c51af8
--- /dev/null
+++ b/runs/ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gatv2_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gatv2",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..527a199
--- /dev/null
+++ b/runs/ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gcn_classic_T0_ns1_h128_e100_s0",
+  "view": "gcn",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "val": {
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+  "test": {
+    "rocauc": 0.7170910489918559
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..d3e7425
--- /dev/null
+++ b/runs/ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gcn_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gcn",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "dev": "cuda:1",
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+  "val": {
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+  "test": {
+    "rocauc": 0.7230304767127982
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..7f6fb10
--- /dev/null
+++ b/runs/ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gen_classic_T0_ns1_h128_e100_s0",
+  "view": "gen",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..360cd3e
--- /dev/null
+++ b/runs/ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gen_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gen",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
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+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "test": {
+    "rocauc": 0.7312107536918231
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..726b2d6
--- /dev/null
+++ b/runs/ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gin_classic_T0_ns1_h128_e100_s0",
+  "view": "gin",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
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+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..4b8b59a
--- /dev/null
+++ b/runs/ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
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+  "tag": "ogbg-moltox21_gin_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gin",
+  "compute": "fixed-rrog",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7236697240762989
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..7885bc7
--- /dev/null
+++ b/runs/ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gine_classic_T0_ns1_h128_e100_s0",
+  "view": "gine",
+  "compute": "classic",
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+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 62.2,
+  "dev": "cuda:1",
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+  "val": {
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+  },
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a4aae8c
--- /dev/null
+++ b/runs/ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_gine_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "gine",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
+  "metric": "rocauc",
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+  "dev": "cuda:1",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..a40d6c8
--- /dev/null
+++ b/runs/ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_graphconv_classic_T0_ns1_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
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+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 47.9,
+  "dev": "cuda:1",
+  "ep": 10,
+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.7147413214946693
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..f7adae0
--- /dev/null
+++ b/runs/ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_graphconv_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphconv",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 74.0,
+  "dev": "cuda:1",
+  "ep": 70,
+  "val": {
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+  "test": {
+    "rocauc": 0.7313192526985618
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..5c3b0e1
--- /dev/null
+++ b/runs/ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_graphsage_classic_T0_ns1_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
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+  "device": "cuda:1",
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+  "sec": 53.4,
+  "dev": "cuda:1",
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+  "val": {
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+  },
+  "test": {
+    "rocauc": 0.719565697251165
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..0974e73
--- /dev/null
+++ b/runs/ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_graphsage_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "graphsage",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "lr": 0.001,
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+  "lam_q": 1.0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "dev": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..2a15684
--- /dev/null
+++ b/runs/ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_mf_classic_T0_ns1_h128_e100_s0",
+  "view": "mf",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "device": "cuda:1",
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+  "sec": 201.7,
+  "dev": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..46d96d7
--- /dev/null
+++ b/runs/ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_mf_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "mf",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "test": {
+    "rocauc": 0.7278719227082299
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4c2d43b
--- /dev/null
+++ b/runs/ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_pna_classic_T0_ns1_h128_e100_s0",
+  "view": "pna",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "dev": "cuda:1",
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+  "test": {
+    "rocauc": 0.6945744978582721
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..aaa52d0
--- /dev/null
+++ b/runs/ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_pna_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "pna",
+  "compute": "fixed-rrog",
+  "T": 1,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
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+  "device": "cuda:1",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ea1e3a5
--- /dev/null
+++ b/runs/ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_resgated_classic_T0_ns1_h128_e100_s0",
+  "view": "resgated",
+  "compute": "classic",
+  "T": 0,
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+  "hidden": 128,
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+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
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+  "test": {
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..a0487e9
--- /dev/null
+++ b/runs/ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_resgated_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "resgated",
+  "compute": "fixed-rrog",
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+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..f1633aa
--- /dev/null
+++ b/runs/ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_sgc_classic_T0_ns1_h128_e100_s0",
+  "view": "sgc",
+  "compute": "classic",
+  "T": 0,
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+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 58.3,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.7611119280457176
+  },
+  "test": {
+    "rocauc": 0.7239907988668123
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..98b0b4c
--- /dev/null
+++ b/runs/ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_sgc_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "sgc",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 83.3,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.7505837592258088
+  },
+  "test": {
+    "rocauc": 0.7354997840876948
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..4adf9bb
--- /dev/null
+++ b/runs/ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_tag_classic_T0_ns1_h128_e100_s0",
+  "view": "tag",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 93.4,
+  "dev": "cuda:1",
+  "ep": 40,
+  "val": {
+    "rocauc": 0.7865543605336435
+  },
+  "test": {
+    "rocauc": 0.7415570498308578
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..560afdf
--- /dev/null
+++ b/runs/ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_tag_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "tag",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 122.8,
+  "dev": "cuda:1",
+  "ep": 50,
+  "val": {
+    "rocauc": 0.7838617216718421
+  },
+  "test": {
+    "rocauc": 0.7341723374058734
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0.json b/runs/ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0.json
new file mode 100644
index 0000000..ec63ce7
--- /dev/null
+++ b/runs/ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_transformer_classic_T0_ns1_h128_e100_s0",
+  "view": "transformer",
+  "compute": "classic",
+  "T": 0,
+  "n_sup": 1,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 133.1,
+  "dev": "cuda:1",
+  "ep": 30,
+  "val": {
+    "rocauc": 0.7656017658932041
+  },
+  "test": {
+    "rocauc": 0.7309364489214464
+  }
+}
\ No newline at end of file
diff --git a/runs/ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json b/runs/ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
new file mode 100644
index 0000000..ff3555e
--- /dev/null
+++ b/runs/ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0.json
@@ -0,0 +1,38 @@
+{
+  "dataset": "ogbg-moltox21",
+  "tag": "ogbg-moltox21_transformer_fixed-rrog_T1_ns3_h128_e100_s0",
+  "view": "transformer",
+  "compute": "fixed-rrog",
+  "T": 1,
+  "n_sup": 3,
+  "hidden": 128,
+  "agg_layers": 5,
+  "compute_layers": 2,
+  "epochs": 100,
+  "eval_every": 10,
+  "lr": 0.001,
+  "bs": 128,
+  "lam_q": 1.0,
+  "halt_max_steps": 8,
+  "halt_min_steps": 1,
+  "halt_target": "loss",
+  "halt_loss_threshold": 0.2,
+  "halt_exploration_prob": 0.1,
+  "q_warmup_epochs": 0,
+  "ema": 0.0,
+  "seed": 0,
+  "num_workers": 0,
+  "max_train_batches": 0,
+  "max_eval_batches": 0,
+  "device": "cuda:1",
+  "metric": "rocauc",
+  "sec": 185.2,
+  "dev": "cuda:1",
+  "ep": 20,
+  "val": {
+    "rocauc": 0.7761466167802987
+  },
+  "test": {
+    "rocauc": 0.7291784660085319
+  }
+}
\ No newline at end of file
diff --git a/summaries/ogb_graphprop.md b/summaries/ogb_graphprop.md
index 5c4a151..f0c8c11 100644
--- a/summaries/ogb_graphprop.md
+++ b/summaries/ogb_graphprop.md
@@ -2,41 +2,330 @@
 Classic baseline: task x backbone
 | task | backbone | metric | n | val | test |
 | --- | --- | --- | --- | --- | --- |
-| ogbg-molhiv | appnp | rocauc | 1 | 0.7675 +/- 0.0000 | 0.7000 +/- 0.0000 |
-| ogbg-molhiv | arma | rocauc | 1 | 0.7872 +/- 0.0000 | 0.7296 +/- 0.0000 |
-| ogbg-molhiv | cheb | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7282 +/- 0.0000 |
-| ogbg-molhiv | film | rocauc | 1 | 0.7922 +/- 0.0000 | 0.7842 +/- 0.0000 |
-| ogbg-molhiv | gatv2 | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7563 +/- 0.0000 |
-| ogbg-molhiv | gcn | rocauc | 1 | 0.7754 +/- 0.0000 | 0.7198 +/- 0.0000 |
-| ogbg-molhiv | gen | rocauc | 1 | 0.7530 +/- 0.0000 | 0.7314 +/- 0.0000 |
-| ogbg-molhiv | gin | rocauc | 1 | 0.8167 +/- 0.0000 | 0.7724 +/- 0.0000 |
-| ogbg-molhiv | gine | rocauc | 1 | 0.7942 +/- 0.0000 | 0.7445 +/- 0.0000 |
-| ogbg-molhiv | graphconv | rocauc | 1 | 0.7707 +/- 0.0000 | 0.7108 +/- 0.0000 |
-| ogbg-molhiv | graphsage | rocauc | 1 | 0.7969 +/- 0.0000 | 0.7625 +/- 0.0000 |
-| ogbg-molhiv | mf | rocauc | 1 | 0.7845 +/- 0.0000 | 0.7074 +/- 0.0000 |
-| ogbg-molhiv | pna | rocauc | 1 | 0.7780 +/- 0.0000 | 0.7648 +/- 0.0000 |
-| ogbg-molhiv | resgated | rocauc | 1 | 0.8144 +/- 0.0000 | 0.7242 +/- 0.0000 |
-| ogbg-molhiv | sgc | rocauc | 1 | 0.7479 +/- 0.0000 | 0.7019 +/- 0.0000 |
-| ogbg-molhiv | tag | rocauc | 1 | 0.7528 +/- 0.0000 | 0.7255 +/- 0.0000 |
-| ogbg-molhiv | transformer | rocauc | 1 | 0.7617 +/- 0.0000 | 0.7547 +/- 0.0000 |
+| ogbg-molbace | appnp | rocauc | 1 | 0.6564 +/- 0.0000 | 0.7423 +/- 0.0000 |
+| ogbg-molbace | arma | rocauc | 1 | 0.6923 +/- 0.0000 | 0.7839 +/- 0.0000 |
+| ogbg-molbace | cheb | rocauc | 1 | 0.7267 +/- 0.0000 | 0.7969 +/- 0.0000 |
+| ogbg-molbace | film | rocauc | 1 | 0.6703 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-molbace | gatv2 | rocauc | 1 | 0.7029 +/- 0.0000 | 0.7400 +/- 0.0000 |
+| ogbg-molbace | gcn | rocauc | 1 | 0.6381 +/- 0.0000 | 0.7393 +/- 0.0000 |
+| ogbg-molbace | gen | rocauc | 1 | 0.7128 +/- 0.0000 | 0.7326 +/- 0.0000 |
+| ogbg-molbace | gin | rocauc | 1 | 0.6520 +/- 0.0000 | 0.7336 +/- 0.0000 |
+| ogbg-molbace | gine | rocauc | 1 | 0.6641 +/- 0.0000 | 0.7454 +/- 0.0000 |
+| ogbg-molbace | graphconv | rocauc | 1 | 0.7311 +/- 0.0000 | 0.8035 +/- 0.0000 |
+| ogbg-molbace | graphsage | rocauc | 1 | 0.6758 +/- 0.0000 | 0.7759 +/- 0.0000 |
+| ogbg-molbace | mf | rocauc | 1 | 0.7421 +/- 0.0000 | 0.7760 +/- 0.0000 |
+| ogbg-molbace | pna | rocauc | 1 | 0.7516 +/- 0.0000 | 0.6912 +/- 0.0000 |
+| ogbg-molbace | resgated | rocauc | 1 | 0.7172 +/- 0.0000 | 0.7877 +/- 0.0000 |
+| ogbg-molbace | sgc | rocauc | 1 | 0.6575 +/- 0.0000 | 0.6966 +/- 0.0000 |
+| ogbg-molbace | tag | rocauc | 1 | 0.7084 +/- 0.0000 | 0.7345 +/- 0.0000 |
+| ogbg-molbace | transformer | rocauc | 1 | 0.6663 +/- 0.0000 | 0.7364 +/- 0.0000 |
+| ogbg-molbbbp | appnp | rocauc | 1 | 0.9147 +/- 0.0000 | 0.6388 +/- 0.0000 |
+| ogbg-molbbbp | arma | rocauc | 1 | 0.9367 +/- 0.0000 | 0.6651 +/- 0.0000 |
+| ogbg-molbbbp | cheb | rocauc | 1 | 0.9452 +/- 0.0000 | 0.6514 +/- 0.0000 |
+| ogbg-molbbbp | film | rocauc | 1 | 0.9285 +/- 0.0000 | 0.6300 +/- 0.0000 |
+| ogbg-molbbbp | gatv2 | rocauc | 1 | 0.9347 +/- 0.0000 | 0.6324 +/- 0.0000 |
+| ogbg-molbbbp | gcn | rocauc | 1 | 0.9386 +/- 0.0000 | 0.6679 +/- 0.0000 |
+| ogbg-molbbbp | gen | rocauc | 1 | 0.9549 +/- 0.0000 | 0.6775 +/- 0.0000 |
+| ogbg-molbbbp | gin | rocauc | 1 | 0.9251 +/- 0.0000 | 0.5670 +/- 0.0000 |
+| ogbg-molbbbp | gine | rocauc | 1 | 0.9324 +/- 0.0000 | 0.6160 +/- 0.0000 |
+| ogbg-molbbbp | graphconv | rocauc | 1 | 0.9268 +/- 0.0000 | 0.5900 +/- 0.0000 |
+| ogbg-molbbbp | graphsage | rocauc | 1 | 0.9483 +/- 0.0000 | 0.6288 +/- 0.0000 |
+| ogbg-molbbbp | mf | rocauc | 1 | 0.9395 +/- 0.0000 | 0.6365 +/- 0.0000 |
+| ogbg-molbbbp | pna | rocauc | 1 | 0.9554 +/- 0.0000 | 0.6418 +/- 0.0000 |
+| ogbg-molbbbp | resgated | rocauc | 1 | 0.9183 +/- 0.0000 | 0.6626 +/- 0.0000 |
+| ogbg-molbbbp | sgc | rocauc | 1 | 0.9300 +/- 0.0000 | 0.6239 +/- 0.0000 |
+| ogbg-molbbbp | tag | rocauc | 1 | 0.9476 +/- 0.0000 | 0.6100 +/- 0.0000 |
+| ogbg-molbbbp | transformer | rocauc | 1 | 0.9495 +/- 0.0000 | 0.6156 +/- 0.0000 |
+| ogbg-molclintox | appnp | rocauc | 1 | 0.8516 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | arma | rocauc | 1 | 0.9463 +/- 0.0000 | 0.8678 +/- 0.0000 |
+| ogbg-molclintox | cheb | rocauc | 1 | 0.8928 +/- 0.0000 | 0.9152 +/- 0.0000 |
+| ogbg-molclintox | film | rocauc | 1 | 0.9048 +/- 0.0000 | 0.7731 +/- 0.0000 |
+| ogbg-molclintox | gatv2 | rocauc | 1 | 0.9515 +/- 0.0000 | 0.8493 +/- 0.0000 |
+| ogbg-molclintox | gcn | rocauc | 1 | 0.9318 +/- 0.0000 | 0.8932 +/- 0.0000 |
+| ogbg-molclintox | gen | rocauc | 1 | 0.9820 +/- 0.0000 | 0.8128 +/- 0.0000 |
+| ogbg-molclintox | gin | rocauc | 1 | 0.9547 +/- 0.0000 | 0.8586 +/- 0.0000 |
+| ogbg-molclintox | gine | rocauc | 1 | 0.9353 +/- 0.0000 | 0.8869 +/- 0.0000 |
+| ogbg-molclintox | graphconv | rocauc | 1 | 0.8917 +/- 0.0000 | 0.8501 +/- 0.0000 |
+| ogbg-molclintox | graphsage | rocauc | 1 | 0.9143 +/- 0.0000 | 0.8882 +/- 0.0000 |
+| ogbg-molclintox | mf | rocauc | 1 | 0.9252 +/- 0.0000 | 0.8370 +/- 0.0000 |
+| ogbg-molclintox | pna | rocauc | 1 | 0.9286 +/- 0.0000 | 0.8603 +/- 0.0000 |
+| ogbg-molclintox | resgated | rocauc | 1 | 0.9244 +/- 0.0000 | 0.9184 +/- 0.0000 |
+| ogbg-molclintox | sgc | rocauc | 1 | 0.9195 +/- 0.0000 | 0.8986 +/- 0.0000 |
+| ogbg-molclintox | tag | rocauc | 1 | 0.9237 +/- 0.0000 | 0.7998 +/- 0.0000 |
+| ogbg-molclintox | transformer | rocauc | 1 | 0.9271 +/- 0.0000 | 0.8764 +/- 0.0000 |
+| ogbg-molesol | appnp | rmse | 1 | 1.6083 +/- 0.0000 | 1.5212 +/- 0.0000 |
+| ogbg-molesol | arma | rmse | 1 | 1.0195 +/- 0.0000 | 1.0666 +/- 0.0000 |
+| ogbg-molesol | cheb | rmse | 1 | 0.9650 +/- 0.0000 | 0.8722 +/- 0.0000 |
+| ogbg-molesol | film | rmse | 1 | 1.0718 +/- 0.0000 | 1.2896 +/- 0.0000 |
+| ogbg-molesol | gatv2 | rmse | 1 | 1.0368 +/- 0.0000 | 0.9878 +/- 0.0000 |
+| ogbg-molesol | gcn | rmse | 1 | 1.0409 +/- 0.0000 | 1.1161 +/- 0.0000 |
+| ogbg-molesol | gen | rmse | 1 | 1.0089 +/- 0.0000 | 0.8762 +/- 0.0000 |
+| ogbg-molesol | gin | rmse | 1 | 1.0187 +/- 0.0000 | 0.9900 +/- 0.0000 |
+| ogbg-molesol | gine | rmse | 1 | 1.0286 +/- 0.0000 | 1.0807 +/- 0.0000 |
+| ogbg-molesol | graphconv | rmse | 1 | 0.9741 +/- 0.0000 | 0.9732 +/- 0.0000 |
+| ogbg-molesol | graphsage | rmse | 1 | 0.9680 +/- 0.0000 | 1.0038 +/- 0.0000 |
+| ogbg-molesol | mf | rmse | 1 | 1.1494 +/- 0.0000 | 1.0639 +/- 0.0000 |
+| ogbg-molesol | pna | rmse | 1 | 0.9116 +/- 0.0000 | 0.9153 +/- 0.0000 |
+| ogbg-molesol | resgated | rmse | 1 | 0.9492 +/- 0.0000 | 0.8908 +/- 0.0000 |
+| ogbg-molesol | sgc | rmse | 1 | 1.0617 +/- 0.0000 | 0.9780 +/- 0.0000 |
+| ogbg-molesol | tag | rmse | 1 | 0.9323 +/- 0.0000 | 0.9678 +/- 0.0000 |
+| ogbg-molesol | transformer | rmse | 1 | 0.9398 +/- 0.0000 | 0.9492 +/- 0.0000 |
+| ogbg-molfreesolv | appnp | rmse | 1 | 6.0462 +/- 0.0000 | 4.6478 +/- 0.0000 |
+| ogbg-molfreesolv | arma | rmse | 1 | 4.2662 +/- 0.0000 | 2.9769 +/- 0.0000 |
+| ogbg-molfreesolv | cheb | rmse | 1 | 2.9481 +/- 0.0000 | 2.2431 +/- 0.0000 |
+| ogbg-molfreesolv | film | rmse | 1 | 3.1546 +/- 0.0000 | 2.9581 +/- 0.0000 |
+| ogbg-molfreesolv | gatv2 | rmse | 1 | 4.2086 +/- 0.0000 | 2.7368 +/- 0.0000 |
+| ogbg-molfreesolv | gcn | rmse | 1 | 3.7172 +/- 0.0000 | 2.4851 +/- 0.0000 |
+| ogbg-molfreesolv | gen | rmse | 1 | 3.9998 +/- 0.0000 | 2.5588 +/- 0.0000 |
+| ogbg-molfreesolv | gin | rmse | 1 | 4.0190 +/- 0.0000 | 3.4898 +/- 0.0000 |
+| ogbg-molfreesolv | gine | rmse | 1 | 3.2961 +/- 0.0000 | 3.1442 +/- 0.0000 |
+| ogbg-molfreesolv | graphconv | rmse | 1 | 2.5314 +/- 0.0000 | 2.7953 +/- 0.0000 |
+| ogbg-molfreesolv | graphsage | rmse | 1 | 3.5022 +/- 0.0000 | 2.2977 +/- 0.0000 |
+| ogbg-molfreesolv | mf | rmse | 1 | 2.7374 +/- 0.0000 | 2.8885 +/- 0.0000 |
+| ogbg-molfreesolv | pna | rmse | 1 | 2.3625 +/- 0.0000 | 2.2610 +/- 0.0000 |
+| ogbg-molfreesolv | resgated | rmse | 1 | 2.4772 +/- 0.0000 | 2.0041 +/- 0.0000 |
+| ogbg-molfreesolv | sgc | rmse | 1 | 3.9147 +/- 0.0000 | 2.4146 +/- 0.0000 |
+| ogbg-molfreesolv | tag | rmse | 1 | 2.6874 +/- 0.0000 | 2.3826 +/- 0.0000 |
+| ogbg-molfreesolv | transformer | rmse | 1 | 4.0942 +/- 0.0000 | 2.3205 +/- 0.0000 |
+| ogbg-molhiv | appnp | rocauc | 3 | 0.7274 +/- 0.0374 | 0.6982 +/- 0.0073 |
+| ogbg-molhiv | arma | rocauc | 3 | 0.7799 +/- 0.0063 | 0.7396 +/- 0.0263 |
+| ogbg-molhiv | cheb | rocauc | 3 | 0.7799 +/- 0.0207 | 0.7264 +/- 0.0039 |
+| ogbg-molhiv | film | rocauc | 3 | 0.7840 +/- 0.0421 | 0.7505 +/- 0.0298 |
+| ogbg-molhiv | gatv2 | rocauc | 3 | 0.7841 +/- 0.0088 | 0.7292 +/- 0.0262 |
+| ogbg-molhiv | gcn | rocauc | 3 | 0.7751 +/- 0.0003 | 0.7360 +/- 0.0190 |
+| ogbg-molhiv | gen | rocauc | 3 | 0.7626 +/- 0.0141 | 0.7438 +/- 0.0126 |
+| ogbg-molhiv | gin | rocauc | 3 | 0.8052 +/- 0.0145 | 0.7600 +/- 0.0179 |
+| ogbg-molhiv | gine | rocauc | 3 | 0.7787 +/- 0.0156 | 0.7505 +/- 0.0200 |
+| ogbg-molhiv | graphconv | rocauc | 3 | 0.7656 +/- 0.0284 | 0.7330 +/- 0.0222 |
+| ogbg-molhiv | graphsage | rocauc | 3 | 0.7865 +/- 0.0102 | 0.7506 +/- 0.0195 |
+| ogbg-molhiv | mf | rocauc | 3 | 0.7718 +/- 0.0137 | 0.7352 +/- 0.0319 |
+| ogbg-molhiv | pna | rocauc | 3 | 0.7943 +/- 0.0148 | 0.7520 +/- 0.0114 |
+| ogbg-molhiv | resgated | rocauc | 3 | 0.7963 +/- 0.0157 | 0.7316 +/- 0.0205 |
+| ogbg-molhiv | sgc | rocauc | 3 | 0.7699 +/- 0.0225 | 0.7038 +/- 0.0055 |
+| ogbg-molhiv | tag | rocauc | 3 | 0.7488 +/- 0.0133 | 0.7432 +/- 0.0156 |
+| ogbg-molhiv | transformer | rocauc | 3 | 0.7668 +/- 0.0086 | 0.7714 +/- 0.0168 |
+| ogbg-mollipo | appnp | rmse | 1 | 0.9015 +/- 0.0000 | 0.9070 +/- 0.0000 |
+| ogbg-mollipo | arma | rmse | 1 | 0.7325 +/- 0.0000 | 0.7295 +/- 0.0000 |
+| ogbg-mollipo | cheb | rmse | 1 | 0.7188 +/- 0.0000 | 0.7180 +/- 0.0000 |
+| ogbg-mollipo | film | rmse | 1 | 0.7620 +/- 0.0000 | 0.7371 +/- 0.0000 |
+| ogbg-mollipo | gatv2 | rmse | 1 | 0.6865 +/- 0.0000 | 0.7308 +/- 0.0000 |
+| ogbg-mollipo | gcn | rmse | 1 | 0.7379 +/- 0.0000 | 0.7828 +/- 0.0000 |
+| ogbg-mollipo | gen | rmse | 1 | 0.7046 +/- 0.0000 | 0.7379 +/- 0.0000 |
+| ogbg-mollipo | gin | rmse | 1 | 0.6854 +/- 0.0000 | 0.7390 +/- 0.0000 |
+| ogbg-mollipo | gine | rmse | 1 | 0.6615 +/- 0.0000 | 0.7341 +/- 0.0000 |
+| ogbg-mollipo | graphconv | rmse | 1 | 0.7178 +/- 0.0000 | 0.7297 +/- 0.0000 |
+| ogbg-mollipo | graphsage | rmse | 1 | 0.7239 +/- 0.0000 | 0.7783 +/- 0.0000 |
+| ogbg-mollipo | mf | rmse | 1 | 0.7129 +/- 0.0000 | 0.7405 +/- 0.0000 |
+| ogbg-mollipo | pna | rmse | 1 | 0.7179 +/- 0.0000 | 0.7749 +/- 0.0000 |
+| ogbg-mollipo | resgated | rmse | 1 | 0.6721 +/- 0.0000 | 0.7270 +/- 0.0000 |
+| ogbg-mollipo | sgc | rmse | 1 | 0.7505 +/- 0.0000 | 0.8176 +/- 0.0000 |
+| ogbg-mollipo | tag | rmse | 1 | 0.6692 +/- 0.0000 | 0.7227 +/- 0.0000 |
+| ogbg-mollipo | transformer | rmse | 1 | 0.6810 +/- 0.0000 | 0.7346 +/- 0.0000 |
+| ogbg-molsider | appnp | rocauc | 1 | 0.5886 +/- 0.0000 | 0.6004 +/- 0.0000 |
+| ogbg-molsider | arma | rocauc | 1 | 0.6273 +/- 0.0000 | 0.6159 +/- 0.0000 |
+| ogbg-molsider | cheb | rocauc | 1 | 0.6237 +/- 0.0000 | 0.6033 +/- 0.0000 |
+| ogbg-molsider | film | rocauc | 1 | 0.6024 +/- 0.0000 | 0.5898 +/- 0.0000 |
+| ogbg-molsider | gatv2 | rocauc | 1 | 0.6071 +/- 0.0000 | 0.6013 +/- 0.0000 |
+| ogbg-molsider | gcn | rocauc | 1 | 0.6293 +/- 0.0000 | 0.6086 +/- 0.0000 |
+| ogbg-molsider | gen | rocauc | 1 | 0.6519 +/- 0.0000 | 0.5854 +/- 0.0000 |
+| ogbg-molsider | gin | rocauc | 1 | 0.6225 +/- 0.0000 | 0.5748 +/- 0.0000 |
+| ogbg-molsider | gine | rocauc | 1 | 0.6327 +/- 0.0000 | 0.5495 +/- 0.0000 |
+| ogbg-molsider | graphconv | rocauc | 1 | 0.5921 +/- 0.0000 | 0.6151 +/- 0.0000 |
+| ogbg-molsider | graphsage | rocauc | 1 | 0.6217 +/- 0.0000 | 0.5807 +/- 0.0000 |
+| ogbg-molsider | mf | rocauc | 1 | 0.6202 +/- 0.0000 | 0.5861 +/- 0.0000 |
+| ogbg-molsider | pna | rocauc | 1 | 0.6219 +/- 0.0000 | 0.5965 +/- 0.0000 |
+| ogbg-molsider | resgated | rocauc | 1 | 0.6209 +/- 0.0000 | 0.5910 +/- 0.0000 |
+| ogbg-molsider | sgc | rocauc | 1 | 0.6174 +/- 0.0000 | 0.6043 +/- 0.0000 |
+| ogbg-molsider | tag | rocauc | 1 | 0.6439 +/- 0.0000 | 0.6143 +/- 0.0000 |
+| ogbg-molsider | transformer | rocauc | 1 | 0.6160 +/- 0.0000 | 0.5980 +/- 0.0000 |
+| ogbg-moltox21 | appnp | rocauc | 1 | 0.7255 +/- 0.0000 | 0.7158 +/- 0.0000 |
+| ogbg-moltox21 | arma | rocauc | 1 | 0.7799 +/- 0.0000 | 0.7223 +/- 0.0000 |
+| ogbg-moltox21 | cheb | rocauc | 1 | 0.7834 +/- 0.0000 | 0.7301 +/- 0.0000 |
+| ogbg-moltox21 | film | rocauc | 1 | 0.7702 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gatv2 | rocauc | 1 | 0.7627 +/- 0.0000 | 0.7160 +/- 0.0000 |
+| ogbg-moltox21 | gcn | rocauc | 1 | 0.7580 +/- 0.0000 | 0.7171 +/- 0.0000 |
+| ogbg-moltox21 | gen | rocauc | 1 | 0.7835 +/- 0.0000 | 0.7444 +/- 0.0000 |
+| ogbg-moltox21 | gin | rocauc | 1 | 0.7690 +/- 0.0000 | 0.7242 +/- 0.0000 |
+| ogbg-moltox21 | gine | rocauc | 1 | 0.7744 +/- 0.0000 | 0.7328 +/- 0.0000 |
+| ogbg-moltox21 | graphconv | rocauc | 1 | 0.7831 +/- 0.0000 | 0.7147 +/- 0.0000 |
+| ogbg-moltox21 | graphsage | rocauc | 1 | 0.7709 +/- 0.0000 | 0.7196 +/- 0.0000 |
+| ogbg-moltox21 | mf | rocauc | 1 | 0.7773 +/- 0.0000 | 0.7281 +/- 0.0000 |
+| ogbg-moltox21 | pna | rocauc | 1 | 0.7660 +/- 0.0000 | 0.6946 +/- 0.0000 |
+| ogbg-moltox21 | resgated | rocauc | 1 | 0.7950 +/- 0.0000 | 0.7275 +/- 0.0000 |
+| ogbg-moltox21 | sgc | rocauc | 1 | 0.7611 +/- 0.0000 | 0.7240 +/- 0.0000 |
+| ogbg-moltox21 | tag | rocauc | 1 | 0.7866 +/- 0.0000 | 0.7416 +/- 0.0000 |
+| ogbg-moltox21 | transformer | rocauc | 1 | 0.7656 +/- 0.0000 | 0.7309 +/- 0.0000 |
 
 Delta vs matching classic
 | task | backbone | compute | metric | n | val score (delta) | test score (delta) | steps |
 | --- | --- | --- | --- | --- | --- | --- | --- |
-| ogbg-molhiv | appnp | fixed-rrog | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
-| ogbg-molhiv | arma | fixed-rrog | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
-| ogbg-molhiv | cheb | fixed-rrog | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
-| ogbg-molhiv | film | fixed-rrog | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
-| ogbg-molhiv | gatv2 | fixed-rrog | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
-| ogbg-molhiv | gcn | fixed-rrog | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
-| ogbg-molhiv | gen | fixed-rrog | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
-| ogbg-molhiv | gin | fixed-rrog | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
-| ogbg-molhiv | gine | fixed-rrog | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
-| ogbg-molhiv | graphconv | fixed-rrog | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
-| ogbg-molhiv | graphsage | fixed-rrog | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
-| ogbg-molhiv | mf | fixed-rrog | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
-| ogbg-molhiv | pna | fixed-rrog | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
-| ogbg-molhiv | resgated | fixed-rrog | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
-| ogbg-molhiv | sgc | fixed-rrog | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
-| ogbg-molhiv | tag | fixed-rrog | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
-| ogbg-molhiv | transformer | fixed-rrog | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-molbace | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7168 (0.0604) | 0.7209 (-0.0214) |  |
+| ogbg-molbace | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7179 (0.0256) | 0.7672 (-0.0167) |  |
+| ogbg-molbace | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7114 (-0.0154) | 0.7533 (-0.0436) |  |
+| ogbg-molbace | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6652 (-0.0051) | 0.7242 (0.0000) |  |
+| ogbg-molbace | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7026 (-0.0004) | 0.7519 (0.0118) |  |
+| ogbg-molbace | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6374 (-0.0007) | 0.7733 (0.0339) |  |
+| ogbg-molbace | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6894 (-0.0234) | 0.7449 (0.0123) |  |
+| ogbg-molbace | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6538 (0.0018) | 0.7169 (-0.0167) |  |
+| ogbg-molbace | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6685 (0.0044) | 0.6994 (-0.0461) |  |
+| ogbg-molbace | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7462 (0.0150) | 0.7983 (-0.0052) |  |
+| ogbg-molbace | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6703 (-0.0055) | 0.7119 (-0.0640) |  |
+| ogbg-molbace | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7234 (-0.0187) | 0.7684 (-0.0077) |  |
+| ogbg-molbace | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7037 (-0.0480) | 0.7967 (0.1055) |  |
+| ogbg-molbace | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6912 (-0.0260) | 0.7465 (-0.0412) |  |
+| ogbg-molbace | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6454 (-0.0121) | 0.7727 (0.0762) |  |
+| ogbg-molbace | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7355 (0.0271) | 0.6806 (-0.0539) |  |
+| ogbg-molbace | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6982 (0.0319) | 0.7487 (0.0123) |  |
+| ogbg-molbbbp | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9360 (0.0213) | 0.6073 (-0.0314) |  |
+| ogbg-molbbbp | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9415 (0.0048) | 0.6635 (-0.0016) |  |
+| ogbg-molbbbp | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9278 (-0.0174) | 0.6659 (0.0145) |  |
+| ogbg-molbbbp | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9400 (0.0115) | 0.6323 (0.0023) |  |
+| ogbg-molbbbp | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9356 (0.0009) | 0.6560 (0.0235) |  |
+| ogbg-molbbbp | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9417 (0.0031) | 0.6017 (-0.0663) |  |
+| ogbg-molbbbp | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9429 (-0.0119) | 0.6037 (-0.0738) |  |
+| ogbg-molbbbp | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9526 (0.0275) | 0.5932 (0.0261) |  |
+| ogbg-molbbbp | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9421 (0.0098) | 0.6976 (0.0816) |  |
+| ogbg-molbbbp | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9337 (0.0069) | 0.6518 (0.0618) |  |
+| ogbg-molbbbp | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9502 (0.0019) | 0.5934 (-0.0354) |  |
+| ogbg-molbbbp | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9488 (0.0094) | 0.6481 (0.0116) |  |
+| ogbg-molbbbp | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9585 (0.0031) | 0.6682 (0.0264) |  |
+| ogbg-molbbbp | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9535 (0.0352) | 0.5839 (-0.0787) |  |
+| ogbg-molbbbp | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9285 (-0.0015) | 0.6454 (0.0215) |  |
+| ogbg-molbbbp | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9459 (-0.0017) | 0.6420 (0.0320) |  |
+| ogbg-molbbbp | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9355 (-0.0140) | 0.6221 (0.0065) |  |
+| ogbg-molclintox | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9029 (0.0513) | 0.8898 (-0.0286) |  |
+| ogbg-molclintox | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9135 (-0.0328) | 0.8863 (0.0185) |  |
+| ogbg-molclintox | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8816 (-0.0112) | 0.8982 (-0.0170) |  |
+| ogbg-molclintox | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9454 (0.0406) | 0.8430 (0.0699) |  |
+| ogbg-molclintox | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9351 (-0.0164) | 0.8328 (-0.0164) |  |
+| ogbg-molclintox | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9097 (-0.0221) | 0.8792 (-0.0140) |  |
+| ogbg-molclintox | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9399 (-0.0421) | 0.8194 (0.0066) |  |
+| ogbg-molclintox | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9164 (-0.0383) | 0.8788 (0.0202) |  |
+| ogbg-molclintox | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9225 (-0.0127) | 0.8840 (-0.0030) |  |
+| ogbg-molclintox | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.8494 (-0.0424) | 0.8186 (-0.0316) |  |
+| ogbg-molclintox | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9579 (0.0436) | 0.8664 (-0.0217) |  |
+| ogbg-molclintox | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9147 (-0.0104) | 0.8047 (-0.0323) |  |
+| ogbg-molclintox | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9064 (-0.0222) | 0.8735 (0.0132) |  |
+| ogbg-molclintox | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9055 (-0.0188) | 0.8979 (-0.0205) |  |
+| ogbg-molclintox | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9220 (0.0025) | 0.9054 (0.0068) |  |
+| ogbg-molclintox | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9183 (-0.0054) | 0.8433 (0.0435) |  |
+| ogbg-molclintox | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.9322 (0.0051) | 0.8522 (-0.0242) |  |
+| ogbg-molesol | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 1.4196 (0.1887) | 1.4929 (0.0284) |  |
+| ogbg-molesol | arma | fixed-rrog-T1-ns3 | rmse | 1 | 1.0034 (0.0160) | 1.1272 (-0.0606) |  |
+| ogbg-molesol | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.9199 (0.0451) | 0.8841 (-0.0118) |  |
+| ogbg-molesol | film | fixed-rrog-T1-ns3 | rmse | 1 | 1.0196 (0.0521) | 1.0849 (0.2047) |  |
+| ogbg-molesol | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 1.0018 (0.0350) | 0.9780 (0.0098) |  |
+| ogbg-molesol | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.9591 (0.0818) | 0.9305 (0.1856) |  |
+| ogbg-molesol | gen | fixed-rrog-T1-ns3 | rmse | 1 | 1.0027 (0.0062) | 0.9206 (-0.0444) |  |
+| ogbg-molesol | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.9647 (0.0540) | 1.0798 (-0.0899) |  |
+| ogbg-molesol | gine | fixed-rrog-T1-ns3 | rmse | 1 | 1.0581 (-0.0295) | 1.0951 (-0.0144) |  |
+| ogbg-molesol | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 1.0048 (-0.0307) | 0.9968 (-0.0236) |  |
+| ogbg-molesol | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.9934 (-0.0254) | 1.0794 (-0.0757) |  |
+| ogbg-molesol | mf | fixed-rrog-T1-ns3 | rmse | 1 | 1.0553 (0.0942) | 1.0368 (0.0271) |  |
+| ogbg-molesol | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0725) | 0.9092 (0.0060) |  |
+| ogbg-molesol | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.9873 (-0.0382) | 0.8825 (0.0083) |  |
+| ogbg-molesol | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 1.0129 (0.0488) | 0.9373 (0.0407) |  |
+| ogbg-molesol | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.9036 (0.0288) | 0.9462 (0.0215) |  |
+| ogbg-molesol | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.9841 (-0.0443) | 1.0004 (-0.0512) |  |
+| ogbg-molfreesolv | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 5.5593 (0.4869) | 3.6549 (0.9928) |  |
+| ogbg-molfreesolv | arma | fixed-rrog-T1-ns3 | rmse | 1 | 5.0683 (-0.8021) | 3.6823 (-0.7053) |  |
+| ogbg-molfreesolv | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 3.0142 (-0.0662) | 2.2399 (0.0032) |  |
+| ogbg-molfreesolv | film | fixed-rrog-T1-ns3 | rmse | 1 | 3.2952 (-0.1406) | 3.3042 (-0.3460) |  |
+| ogbg-molfreesolv | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 3.9984 (0.2103) | 2.5966 (0.1403) |  |
+| ogbg-molfreesolv | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 3.5888 (0.1285) | 2.4444 (0.0407) |  |
+| ogbg-molfreesolv | gen | fixed-rrog-T1-ns3 | rmse | 1 | 4.3009 (-0.3011) | 2.9063 (-0.3476) |  |
+| ogbg-molfreesolv | gin | fixed-rrog-T1-ns3 | rmse | 1 | 3.9743 (0.0447) | 3.4292 (0.0607) |  |
+| ogbg-molfreesolv | gine | fixed-rrog-T1-ns3 | rmse | 1 | 4.4468 (-1.1508) | 3.7405 (-0.5963) |  |
+| ogbg-molfreesolv | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 2.9106 (-0.3792) | 3.1429 (-0.3476) |  |
+| ogbg-molfreesolv | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 3.7380 (-0.2358) | 2.1931 (0.1046) |  |
+| ogbg-molfreesolv | mf | fixed-rrog-T1-ns3 | rmse | 1 | 2.5060 (0.2313) | 3.1892 (-0.3007) |  |
+| ogbg-molfreesolv | pna | fixed-rrog-T1-ns3 | rmse | 1 | 3.3334 (-0.9708) | 2.4279 (-0.1669) |  |
+| ogbg-molfreesolv | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 3.0920 (-0.6148) | 2.0244 (-0.0203) |  |
+| ogbg-molfreesolv | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 3.9261 (-0.0114) | 2.4887 (-0.0741) |  |
+| ogbg-molfreesolv | tag | fixed-rrog-T1-ns3 | rmse | 1 | 2.7359 (-0.0486) | 2.0588 (0.3237) |  |
+| ogbg-molfreesolv | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 4.4180 (-0.3237) | 2.4325 (-0.1120) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7568 (0.0294) | 0.7303 (0.0321) |  |
+| ogbg-molhiv | appnp | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7203 (-0.0471) | 0.6825 (-0.0175) |  |
+| ogbg-molhiv | arma | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7823 (0.0023) | 0.7120 (-0.0276) |  |
+| ogbg-molhiv | arma | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7926 (0.0054) | 0.7318 (0.0021) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7898 (0.0099) | 0.7347 (0.0083) |  |
+| ogbg-molhiv | cheb | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7735 (-0.0096) | 0.7426 (0.0144) |  |
+| ogbg-molhiv | film | fixed-rrog-T1-ns3 | rocauc | 3 | 0.8070 (0.0230) | 0.7523 (0.0018) |  |
+| ogbg-molhiv | film | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7633 (-0.0288) | 0.7728 (-0.0114) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7734 (-0.0106) | 0.7269 (-0.0023) |  |
+| ogbg-molhiv | gatv2 | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7835 (0.0001) | 0.7466 (-0.0096) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7829 (0.0078) | 0.7386 (0.0026) |  |
+| ogbg-molhiv | gcn | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7455 (-0.0300) | 0.7483 (0.0285) |  |
+| ogbg-molhiv | gen | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7664 (0.0038) | 0.7487 (0.0049) |  |
+| ogbg-molhiv | gen | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8128 (0.0598) | 0.7631 (0.0318) |  |
+| ogbg-molhiv | gin | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7710 (-0.0342) | 0.7548 (-0.0052) |  |
+| ogbg-molhiv | gin | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7524 (-0.0644) | 0.7324 (-0.0400) |  |
+| ogbg-molhiv | gine | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7646 (-0.0140) | 0.7352 (-0.0153) |  |
+| ogbg-molhiv | gine | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7575 (-0.0368) | 0.7401 (-0.0044) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7755 (0.0099) | 0.7305 (-0.0025) |  |
+| ogbg-molhiv | graphconv | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7713 (0.0006) | 0.6979 (-0.0129) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7860 (-0.0005) | 0.7290 (-0.0216) |  |
+| ogbg-molhiv | graphsage | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7587 (-0.0382) | 0.7641 (0.0016) |  |
+| ogbg-molhiv | mf | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7826 (0.0109) | 0.7127 (-0.0225) |  |
+| ogbg-molhiv | mf | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7931 (0.0085) | 0.7217 (0.0143) |  |
+| ogbg-molhiv | pna | fixed-rrog-T1-ns3 | rocauc | 3 | 0.8141 (0.0198) | 0.7503 (-0.0018) |  |
+| ogbg-molhiv | pna | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7890 (0.0111) | 0.7630 (-0.0018) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T1-ns3 | rocauc | 3 | 0.8020 (0.0057) | 0.7383 (0.0066) |  |
+| ogbg-molhiv | resgated | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8174 (0.0030) | 0.7055 (-0.0187) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7643 (-0.0056) | 0.7105 (0.0067) |  |
+| ogbg-molhiv | sgc | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7482 (0.0003) | 0.7177 (0.0158) |  |
+| ogbg-molhiv | tag | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7554 (0.0066) | 0.7339 (-0.0093) |  |
+| ogbg-molhiv | tag | fixed-rrog-T3-ns3 | rocauc | 1 | 0.7804 (0.0276) | 0.7352 (0.0096) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T1-ns3 | rocauc | 3 | 0.7844 (0.0177) | 0.7637 (-0.0077) |  |
+| ogbg-molhiv | transformer | fixed-rrog-T3-ns3 | rocauc | 1 | 0.8088 (0.0471) | 0.7413 (-0.0134) |  |
+| ogbg-mollipo | appnp | fixed-rrog-T1-ns3 | rmse | 1 | 0.8393 (0.0622) | 0.9174 (-0.0104) |  |
+| ogbg-mollipo | arma | fixed-rrog-T1-ns3 | rmse | 1 | 0.7173 (0.0152) | 0.7548 (-0.0253) |  |
+| ogbg-mollipo | cheb | fixed-rrog-T1-ns3 | rmse | 1 | 0.6990 (0.0198) | 0.7132 (0.0048) |  |
+| ogbg-mollipo | film | fixed-rrog-T1-ns3 | rmse | 1 | 0.8122 (-0.0502) | 0.7353 (0.0018) |  |
+| ogbg-mollipo | gatv2 | fixed-rrog-T1-ns3 | rmse | 1 | 0.7080 (-0.0215) | 0.7334 (-0.0026) |  |
+| ogbg-mollipo | gcn | fixed-rrog-T1-ns3 | rmse | 1 | 0.7730 (-0.0351) | 0.7759 (0.0069) |  |
+| ogbg-mollipo | gen | fixed-rrog-T1-ns3 | rmse | 1 | 0.6594 (0.0452) | 0.7456 (-0.0077) |  |
+| ogbg-mollipo | gin | fixed-rrog-T1-ns3 | rmse | 1 | 0.6749 (0.0105) | 0.7073 (0.0317) |  |
+| ogbg-mollipo | gine | fixed-rrog-T1-ns3 | rmse | 1 | 0.7168 (-0.0553) | 0.7316 (0.0025) |  |
+| ogbg-mollipo | graphconv | fixed-rrog-T1-ns3 | rmse | 1 | 0.7372 (-0.0195) | 0.7396 (-0.0099) |  |
+| ogbg-mollipo | graphsage | fixed-rrog-T1-ns3 | rmse | 1 | 0.7184 (0.0055) | 0.7720 (0.0063) |  |
+| ogbg-mollipo | mf | fixed-rrog-T1-ns3 | rmse | 1 | 0.7050 (0.0080) | 0.7101 (0.0304) |  |
+| ogbg-mollipo | pna | fixed-rrog-T1-ns3 | rmse | 1 | 0.7466 (-0.0287) | 0.7908 (-0.0159) |  |
+| ogbg-mollipo | resgated | fixed-rrog-T1-ns3 | rmse | 1 | 0.6766 (-0.0046) | 0.7144 (0.0126) |  |
+| ogbg-mollipo | sgc | fixed-rrog-T1-ns3 | rmse | 1 | 0.7537 (-0.0032) | 0.7490 (0.0685) |  |
+| ogbg-mollipo | tag | fixed-rrog-T1-ns3 | rmse | 1 | 0.6743 (-0.0052) | 0.7201 (0.0026) |  |
+| ogbg-mollipo | transformer | fixed-rrog-T1-ns3 | rmse | 1 | 0.6688 (0.0121) | 0.7396 (-0.0050) |  |
+| ogbg-molsider | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5938 (0.0051) | 0.5905 (-0.0099) |  |
+| ogbg-molsider | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6344 (0.0071) | 0.6141 (-0.0018) |  |
+| ogbg-molsider | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6263 (0.0026) | 0.6096 (0.0062) |  |
+| ogbg-molsider | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.5862 (-0.0162) | 0.5974 (0.0076) |  |
+| ogbg-molsider | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6462 (0.0391) | 0.6000 (-0.0013) |  |
+| ogbg-molsider | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6256 (-0.0037) | 0.6117 (0.0031) |  |
+| ogbg-molsider | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6345 (-0.0175) | 0.6053 (0.0199) |  |
+| ogbg-molsider | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6046 (-0.0179) | 0.6022 (0.0274) |  |
+| ogbg-molsider | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0176) | 0.6150 (0.0655) |  |
+| ogbg-molsider | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6010 (0.0089) | 0.5963 (-0.0188) |  |
+| ogbg-molsider | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6232 (0.0015) | 0.5861 (0.0053) |  |
+| ogbg-molsider | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6190 (-0.0012) | 0.5983 (0.0122) |  |
+| ogbg-molsider | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6058 (-0.0161) | 0.5721 (-0.0243) |  |
+| ogbg-molsider | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6205 (-0.0005) | 0.5960 (0.0050) |  |
+| ogbg-molsider | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6151 (-0.0022) | 0.6417 (0.0375) |  |
+| ogbg-molsider | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6410 (-0.0028) | 0.6102 (-0.0041) |  |
+| ogbg-molsider | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.6315 (0.0156) | 0.6190 (0.0210) |  |
+| ogbg-moltox21 | appnp | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7280 (0.0025) | 0.7154 (-0.0005) |  |
+| ogbg-moltox21 | arma | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7771 (-0.0028) | 0.7209 (-0.0014) |  |
+| ogbg-moltox21 | cheb | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7710 (-0.0125) | 0.7286 (-0.0015) |  |
+| ogbg-moltox21 | film | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7727 (0.0025) | 0.7369 (0.0209) |  |
+| ogbg-moltox21 | gatv2 | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7762 (0.0135) | 0.7303 (0.0143) |  |
+| ogbg-moltox21 | gcn | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7588 (0.0007) | 0.7230 (0.0059) |  |
+| ogbg-moltox21 | gen | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7757 (-0.0077) | 0.7312 (-0.0132) |  |
+| ogbg-moltox21 | gin | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7718 (0.0028) | 0.7237 (-0.0005) |  |
+| ogbg-moltox21 | gine | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7622 (-0.0122) | 0.7193 (-0.0135) |  |
+| ogbg-moltox21 | graphconv | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7820 (-0.0011) | 0.7313 (0.0166) |  |
+| ogbg-moltox21 | graphsage | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7697 (-0.0012) | 0.7205 (0.0009) |  |
+| ogbg-moltox21 | mf | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7695 (-0.0078) | 0.7279 (-0.0002) |  |
+| ogbg-moltox21 | pna | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7745 (0.0085) | 0.7349 (0.0403) |  |
+| ogbg-moltox21 | resgated | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7887 (-0.0064) | 0.7380 (0.0104) |  |
+| ogbg-moltox21 | sgc | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7506 (-0.0105) | 0.7355 (0.0115) |  |
+| ogbg-moltox21 | tag | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7839 (-0.0027) | 0.7342 (-0.0074) |  |
+| ogbg-moltox21 | transformer | fixed-rrog-T1-ns3 | rocauc | 1 | 0.7761 (0.0105) | 0.7292 (-0.0018) |  |
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cgit v1.2.3