| Task Name | Dataset Name | SOTA Result | Trend | |
|---|---|---|---|---|
| Molecular Generation | parp1 | Top-Hit 5% Docking Score (kcal/mol)-14.168 | 27 | |
| Molecular docking | parp1 | Mean Docking Score-13.129 | 18 | |
| Molecular Generation | parp1 | Number of Circles215 | 12 | |
| Molecular Generation | PARP1 | Novel Hit Ratio701.7 | 10 | |
| Molecular optimization | PARP1 online | Hit Ratio69.403 | 8 | |
| Molecular Optimization | PARP1 (offline) | Hit Ratio45.628 | 5 |