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ResearchFormerly WizWand

Molecular Interaction Prediction on CombiSolv

0.303RMSEMMGNN
0.285880.401440.5170.63256Feb 7, 2025Apr 25, 2025Jul 11, 2025Sep 26, 2025Dec 12, 2025Feb 27, 2026May 16, 2026
Updated 5mo ago

Evaluation results

MethodLinks
MMGNNAlignment Strategy=Representational Alignment by Attention-based Inductive Bias2025.020.303
ReAlignFitGCNAlignment Strategy=Representational Alignment by Attention-based Inductive Bias, Backbone=GCN2025.020.316
ReAlignFitGINAlignment Strategy=Representational Alignment by Attention-based Inductive Bias, Backbone=GIN2025.020.318
ReAlignFitAlignment Strategy=Representational Alignment by Attention-based Inductive Bias2025.020.367
ISEAlignment Strategy=Representational Alignment by Attention-based Inductive Bias2025.020.4
CMRLAlignment Strategy=Representational Alignment by Attention-based Inductive Bias2025.020.421
ReAlignFitGATAlignment Strategy=Representational Alignment by Attention-based Inductive Bias, Backbone=GAT2025.020.421
CGIBAlignment Strategy=Representational Alignment by Attention-based Inductive Bias2025.020.422
CIGINAlignment Strategy=No Representational Alignment, Backbone=CIGIN2025.020.451
DisTransTransfer Ratio=70%2026.050.528
CGIB2026.050.538
CausalGIB2026.050.541
DisTransTransfer Ratio=50%2026.050.541
MMGNN2026.050.546
CMRL2026.050.551
DisTransTransfer Ratio=30%2026.050.556
MPNNAlignment Strategy=No Representational Alignment, Backbone=MPNN2025.020.568
IGIB-ISE2026.050.572
BIT2026.050.582
GINAlignment Strategy=No Representational Alignment, Backbone=GIN2025.020.595
Meta-MolNet2026.050.596
CIGIN2026.050.607
MIRACLE2026.050.631
GATAlignment Strategy=No Representational Alignment, Backbone=GAT2025.020.662
GINE2026.050.669
GCNAlignment Strategy=No Representational Alignment, Backbone=GCN2025.020.672
GCN2026.050.675
MPNN2026.050.682
GAT2026.050.731