Molecular Generation on ZINC250K (QED, SA, Rings)
0.922QEDCSMC
Evaluation Results
| Method | Links | |||
|---|---|---|---|---|
| CSMCBase Model=SEDD-U2026.02 | 0.922 | 5.499 | 0.898 | |
| CSMCBase Model=USM2026.02 | 0.917 | 8.703 | 0.898 | |
| CSMC-BBase Model=MDM2026.02 | 0.914 | 6.032 | 0.903 | |
| CSMCBase Model=MDM2026.02 | 0.91 | 8.091 | 0.905 | |
| CSMC-BBase Model=USM2026.02 | 0.91 | 6.31 | 0.895 | |
| BoNBase Model=SEDD-U2026.02 | 0.904 | 4.056 | 0.889 | |
| BoNBase Model=USM2026.02 | 0.901 | 4.184 | 0.889 | |
| CSMC-BBase Model=SEDD-U2026.02 | 0.894 | 3.625 | 0.883 | |
| CSMCBase Model=SEDD-M2026.02 | 0.875 | 10.026 | 0.885 | |
| BoNBase Model=MDM2026.02 | 0.854 | 3.854 | 0.862 | |
| BoNBase Model=SEDD-M2026.02 | 0.852 | 4.057 | 0.857 | |
| SMCBase Model=SEDD-U2026.02 | 0.85 | 2.61 | 0.847 | |
| CSMC-BBase Model=SEDD-M2026.02 | 0.846 | 5.677 | 0.863 | |
| SGDDBase Model=SEDD-U2026.02 | 0.844 | 2.535 | 0.847 | |
| SVDDBase Model=SEDD-U2026.02 | 0.809 | 2.759 | 0.817 | |
| SVDDBase Model=MDM2026.02 | 0.776 | 2.49 | 0.754 | |
| SMCBase Model=USM2026.02 | 0.75 | 2.633 | 0.785 | |
| SVDDBase Model=USM2026.02 | 0.75 | 2.562 | 0.773 | |
| PretrainedBase Model=SEDD-U2026.02 | 0.741 | 2.524 | 0.771 | |
| PretrainedBase Model=USM2026.02 | 0.739 | 2.598 | 0.768 | |
| PretrainedBase Model=SEDD-M2026.02 | 0.669 | 2.35 | 0.731 | |
| SMCBase Model=SEDD-M2026.02 | 0.669 | 2.251 | 0.745 | |
| SVDDBase Model=SEDD-M2026.02 | 0.666 | 2.362 | 0.739 | |
| PretrainedBase Model=MDM2026.02 | 0.663 | 2.02 | 0.742 | |
| SMCBase Model=MDM2026.02 | 0.637 | 2.128 | 0.769 |