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ResearchFormerly WizWand

Property Prediction on AMES (ROC-AUC, PR-AUC)

0.886ROC-AUCODC
0.56880.651150.73350.81585Mar 5, 2024Mar 31, 2024Apr 27, 2024May 23, 2024Jun 19, 2024Jul 15, 2024Aug 11, 2024
Updated 7mo ago

Evaluation results

MethodLinks
ODCSecret Bases=SameSpan-Orth2024.030.8860.899
Central2024.030.8710.887
Imakura-DCSecret Bases=SameSpan2024.030.8660.882
Imakura-DCSecret Bases=SameSpan-Orth2024.030.8620.879
Kawakami-DCSecret Bases=SameSpan-Orth2024.030.8240.838
NeuralFP2024.080.823—
Kawakami-DCSecret Bases=SameSpan2024.030.8220.837
GCN2024.080.818—
SMILES-Mamba2024.080.801—
Morgan+MLP2024.080.794—
SMILES+CNN2024.080.776—
ODCSecret Bases=DiffSpan-Orth2024.030.6790.715
Kawakami-DCSecret Bases=DiffSpan-Orth2024.030.6540.691
Kawakami-DCSecret Bases=DiffSpan2024.030.6520.69
Imakura-DCSecret Bases=DiffSpan-Orth2024.030.6310.669
Imakura-DCSecret Bases=DiffSpan2024.030.6190.656
ODCSecret Bases=SameSpan2024.030.5990.625
ODCSecret Bases=DiffSpan2024.030.5810.62