Molecular Generation on BRAF (Novel hit ratio)
534Novel Hit RatioChemBFN
Evaluation results
| Method | Links | |
|---|---|---|
| ChemBFNstrategy=strategy 1, sampling steps=1,000, format=SMILES, number of runs=52024.12 | 534 | |
| ChemBFNstrategy=strategy 2, sampling steps=1,000, format=SMILES, number of runs=52024.12 | 529.3 | |
| MOODsampling steps=1,000, format=SMILES, number of runs=52024.12 | 524 | |
| ChemBFNstrategy=strategy 4, sampling steps=1,000, format=SMILES, number of runs=52024.12 | 423.3 | |
| ChemBFNstrategy=strategy 3, sampling steps=1,000, format=SMILES, number of runs=52024.12 | 316 | |
| FREEDsampling steps=1,000, format=SMILES, number of runs=52024.12 | 206.7 | |
| HierVAEsampling steps=1,000, format=SMILES, number of runs=52024.12 | 20.7 | |
| GDSSsampling steps=1,000, format=SMILES, number of runs=52024.12 | 16.7 | |
| REINVENTsampling steps=1,000, format=SMILES, number of runs=52024.12 | 12.7 | |
| MOOD-S++2026.04 | 5.653 | |
| MOOD2026.04 | 5.24 | |
| MORLDsampling steps=1,000, format=SMILES, number of runs=52024.12 | 4.7 |