Molecule generation on QM9 (Validity, Uniqueness, Stability)
98.43ValidityDiP
Evaluation results
| Method | Links | ||||
|---|---|---|---|---|---|
| DiPGroup=Tetrahedron2025.10 | 98.43 | 97.02 | 95.26 | 99.56 | |
| DiPGroup={e}2025.10 | 97.09 | 96.56 | 91.54 | 99.29 | |
| ADiTTraining Setup=Jointly trained2025.10 | 94.45 | 97.82 | — | — | |
| GeoLDM2025.10 | 93.8 | 98.82 | 89.4 | 98.9 | |
| ZATOM-1Training Setup=QM9-only2025.10 | 92.88 | 97.71 | — | — | |
| ADiTTraining Setup=QM9-only2025.10 | 92.19 | 97.9 | — | — | |
| EDM2025.10 | 91.9 | 98.69 | 82 | 98.7 | |
| Symphony2025.10 | 83.5 | 97.98 | 83.5 | — |