Drug Discovery On Clintox
Metrics
AUC
Results
Performance results of various models on this benchmark
Model Name | AUC | Paper Title | Repository |
|---|---|---|---|
| BiLSTM | 0.97 | Accelerating Drug Safety Assessment using Bidirectional-LSTM for SMILES Data | |
| TrimNet | 0.948 | TrimNet: learning molecular representation from triplet messages for biomedicine | |
| GIT-Mol(G+S) | 0.883 | GIT-Mol: A Multi-modal Large Language Model for Molecular Science with Graph, Image, and Text | |
| ContextPred | 0.726 | Strategies for Pre-training Graph Neural Networks | - |
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