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ResearchFormerly WizWand

Regression on MoleculeNet ESOL

0.72RMSETRIDENT
0.679160.954831.23051.50617Jun 26, 2025Aug 18, 2025Oct 11, 2025Dec 3, 2025Jan 26, 2026Mar 20, 2026May 13, 2026
Updated 5mo ago

Evaluation results

MethodLinks
TRIDENTvariant=M-M2025.060.72
MolXPT2025.060.75
MolFormer2025.060.78
Uni-Mol2025.060.79
BioT5+2025.060.79
BioT52025.060.8
MolT52025.060.82
ChemBERTa-2Pre-training strategy=MTR, Pre-training size=10M2026.050.858
ChemBERTa-2Pre-training strategy=MTR, Pre-training size=5M2026.050.874
GCNPre-training strategy=None2026.050.885
ChemBERTa-2Pre-training strategy=MTR, Pre-training size=77M2026.050.889
Chem-GMNetPre-training strategy=scratch, k=102026.050.938
ChemBERTa-2Pre-training strategy=MLM, Pre-training size=5M2026.050.946
ChemBERTa-2Pre-training strategy=MLM, Pre-training size=10M2026.050.961
Chem-GMNetPre-training strategy=MLM, Pre-training size=10M2026.050.97
Chem-GMNetPre-training strategy=scratch, k=82026.051.01
ChemBERTa-2Pre-training strategy=MLM, Pre-training size=77M2026.051.025
D-MPNN (Chemprop)Pre-training strategy=None2026.051.105
Random ForestPre-training strategy=None2026.051.741