Chirality classification on SPICE Chirality (test)
100Accuracy (R-class)MACE-Gaunt
Evaluation results
| Method | Links | |||
|---|---|---|---|---|
| MACE-GauntTraining Set=R-only2026.07 | 100 | 0 | 46.3 | |
| MACETraining Set=R-only2026.07 | 100 | 88.6 | 93.9 | |
| NequIPTraining Set=R-only2026.07 | 100 | 90.8 | 95 | |
| SpinGTPTraining Set=R-only2026.07 | 100 | 94.1 | 97.2 |