Molecular Design on SARS-CoV-2 RdRp_6YYT target
-11.84Docking ScoreMolRL-MGPT
Evaluation results
| Method | Links | ||||
|---|---|---|---|---|---|
| MolRL-MGPTCandidate selection=top-1002023.12 | -11.84 | 0.278 | 2.894 | 0.67 | |
| ReinventCandidate selection=top-1002023.12 | -11.3 | 0.275 | 2.917 | 0.616 | |
| GraphGACandidate selection=top-1002023.12 | -11.26 | 0.262 | 3.52 | 0.658 | |
| GFlowNetCandidate selection=top-1002023.12 | -8.89 | 0.656 | 2.854 | 0.77 | |
| JT-VAECandidate selection=top-1002023.12 | -8.33 | 0.719 | 2.959 | 0.828 |