Multi-objective molecular optimization (QED + JNK3 + GSK3β) on ZINC20 (Hypervolume)
0.644HypervolumeATOM
Evaluation results
| Method | Links | |
|---|---|---|
| ATOM2026.03 | 0.644 | |
| GP BO2026.03 | 0.64 | |
| GRAPH GA2026.03 | 0.61 | |
| SMILES GA2026.03 | 0.609 | |
| STONED2026.03 | 0.603 | |
| EAG2026.03 | 0.519 | |
| Drugassist2026.03 | 0.501 | |
| GPT4o-mini2026.03 | 0.499 | |
| SMILES LSTM2026.03 | 0.445 |