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ResearchFormerly WizWand

Molecular Property Prediction on MOLTOX21

0.7895ROC-AUCGraph-ViT + GFSA
0.7304280.7457640.76110.776436Dec 7, 2023May 4, 2024Oct 1, 2024Feb 27, 2025Jul 27, 2025Dec 23, 2025May 22, 2026
Updated 5mo ago

Evaluation results

MethodLinks
Graph-ViT + GFSAGFSA=true2023.120.7895
Graph-ViTGFSA=false2023.120.7851
PRiSMBackbone=GatedGCN2026.050.783
OAPBackbone=GatedGCN2026.050.783
DSS-GNN (EGO+)2024.040.7795
MAPBackbone=GatedGCN2026.050.777
GRANOLA-MSBackbone=GIN2024.040.7732
GRANOLABackbone=GIN2024.040.7719
SignNetBackbone=GatedGCN2026.050.769
DS-GNN (EGO+)2024.040.7639
MAPBackbone=PNA2026.050.763
DS-GNN (NM)2024.040.7625
PRiSMBackbone=PNA2026.050.762
OAPBackbone=PNA2026.050.761
GRANOLA-NO-RNFBackbone=GIN2024.040.7587
GCN2024.040.7529
RECONSTR. GNN2024.040.7515
GINNormalization=BatchNorm, Encoding=RNF-PE2024.040.7514
GINNormalization=RNF-NORM2024.040.7512
GINNormalization=SuperNorm2024.040.7508
GINNormalization=LayerNorm-graph2024.040.7503
GINNormalization=MeanSubtractionNorm2024.040.7498
GIN2024.040.7491
GINNormalization=BatchNorm2024.040.7491
GINNormalization=LayerNorm-node2024.040.7481
GINNormalization=DiffGroupNorm2024.040.7448
SignNetBackbone=PNA2026.050.744
GINNormalization=GraphSizeNorm2024.040.7407
GINNormalization=InstanceNorm2024.040.7382
GINNormalization=GraphNorm2024.040.7354
GINNormalization=Identity2024.040.7334
GINNormalization=PairNorm2024.040.7327
GINNormalization=NodeNorm2024.040.7327