Molecule Generation on QM9 (Structural Validity Checks)
100Atom Connectivity Pass RateZATOM-1-WD
Evaluation Results
| Method | Links | |||||||
|---|---|---|---|---|---|---|---|---|
| ZATOM-1-WDWeight Decay=True2025.10 | 100 | 99.91 | 99.94 | 100 | 100 | 99.79 | 99.84 | |
| DiP-{e}Symmetry Group={e} (trivial)2025.10 | 100 | 99.87 | 99.92 | 100 | 100 | 99.87 | 100 | |
| DiP-Tetra.Symmetry Group=Tetrahedron2025.10 | 100 | 99.91 | 99.95 | 100 | 100 | 99.89 | 100 | |
| ZATOM-12026.02 | 99.98 | 99.95 | 99.97 | 100 | 100 | 99.78 | 99.81 | |
| ZATOM-12025.10 | 99.98 | 99.95 | 99.97 | 100 | 99.99 | 99.78 | 99.81 | |
| Symphony2026.02 | 99.92 | 99.56 | 98.72 | 100 | 99.07 | 95.65 | 98.16 | |
| Symphony2025.10 | 99.92 | 99.56 | 98.72 | 100 | 99.07 | 95.65 | 98.16 | |
| Eq. Diff.full_name=Equivariant Diffusion2026.02 | 99.88 | 99.98 | 100 | 100 | 98.58 | 94.88 | 99.79 | |
| Eq. Diff.2025.10 | 99.88 | 99.98 | 100 | 100 | 98.58 | 94.88 | 99.79 | |
| ADiT2026.02 | 99.7 | 99.85 | 99.41 | 100 | 99.98 | 95.86 | 99.79 | |
| ADiT2025.10 | 99.7 | 99.85 | 99.41 | 100 | 99.98 | 95.86 | 99.79 |