Hit Identification on Sol-Hi Lo-Hi
0.64AUPRCHyformer
Evaluation results
| Method | Links | |
|---|---|---|
| HyformerTraining Strategy=Joint pre-training2025.04 | 0.64 | |
| Chemprop2025.04 | 0.618 | |
| HyformerTraining Strategy=no-joint (MLM loss only)2025.04 | 0.601 | |
| GBMolecular Descriptor=MACCS2025.04 | 0.502 | |
| MLPMolecular Descriptor=MACCS2025.04 | 0.462 | |
| GBMolecular Descriptor=ECFP42025.04 | 0.429 | |
| KNNMolecular Descriptor=ECFP42025.04 | 0.426 | |
| KNNMolecular Descriptor=MACCS2025.04 | 0.422 | |
| MLPMolecular Descriptor=ECFP42025.04 | 0.403 | |
| SVMMolecular Descriptor=MACCS2025.04 | 0.308 | |
| SVMMolecular Descriptor=ECFP42025.04 | 0.298 | |
| Dummy baseline2025.04 | 0.215 |