Atomistic Description on Aspirin
Metric: MAE (lower is better)
Metric: MAE (lower is better)
| # | Model↕ | MAE▲ | Extra Data | Paper | Date↕ | Code |
|---|---|---|---|---|---|---|
| 1 | NequIP | 9.27 | No | EGraFFBench: Evaluation of Equivariant Graph Neu... | 2023-10-03 | - |
| 2 | BOTNet | 12.63 | No | EGraFFBench: Evaluation of Equivariant Graph Neu... | 2023-10-03 | - |
| 3 | MACE | 13.79 | No | EGraFFBench: Evaluation of Equivariant Graph Neu... | 2023-10-03 | - |
| 4 | Allegro | 14.36 | No | EGraFFBench: Evaluation of Equivariant Graph Neu... | 2023-10-03 | - |