Multi-property conditional molecule generation on GuacaMol
430.8Unique MoleculesProbTransformer
Evaluation Results
| Method | Links | |
|---|---|---|
| ProbTransformerTarget (TPSA, LogP, SAS)=(80.0, 6.0, 2.0)2022.05 | 430.8 | |
| MolGPTTarget (TPSA, LogP, SAS)=(80.0, 6.0, 2.0)2022.05 | 246 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(80.0, 2.0, 2.0)2022.05 | 220.2 | |
| MolGPTTarget (TPSA, LogP, SAS)=(80.0, 2.0, 2.0)2022.05 | 105 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(40.0, 6.0, 2.0)2022.05 | 102.4 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(40.0, 2.0, 2.0)2022.05 | 80.4 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(80.0, 6.0, 4.0)2022.05 | 60.8 | |
| MolGPTTarget (TPSA, LogP, SAS)=(40.0, 2.0, 2.0)2022.05 | 58 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(80.0, 2.0, 4.0)2022.05 | 55.4 | |
| MolGPTTarget (TPSA, LogP, SAS)=(80.0, 6.0, 4.0)2022.05 | 50 | |
| MolGPTTarget (TPSA, LogP, SAS)=(80.0, 2.0, 4.0)2022.05 | 49 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(40.0, 2.0, 4.0)2022.05 | 48.6 | |
| MolGPTTarget (TPSA, LogP, SAS)=(40.0, 6.0, 2.0)2022.05 | 44 | |
| ProbTransformerTarget (TPSA, LogP, SAS)=(40.0, 6.0, 4.0)2022.05 | 40.4 | |
| MolGPTTarget (TPSA, LogP, SAS)=(40.0, 2.0, 4.0)2022.05 | 25 | |
| MolGPTTarget (TPSA, LogP, SAS)=(40.0, 6.0, 4.0)2022.05 | 20 |