Interatomic Potential Prediction on MD22 Stachyose (test)
0.053Energy MAEICTPsym
Evaluation results
| Method | Links | ||
|---|---|---|---|
| ICTPsym2024.05 | 0.053 | 2.51 | |
| ViSNet-LSRM2024.05 | 0.053 | 3.33 | |
| MACE2024.05 | 0.062 | 3.8 | |
| TorchMD-Net2024.05 | 0.069 | 8.33 | |
| Equiformer2024.05 | 0.07 | 2.75 | |
| Allegro2024.05 | 0.124 | 4.21 | |
| SO3krates2024.05 | 0.22 | 18.86 | |
| sGDML2024.05 | 1.995 | 29.49 |