Molecular Energy and Torsional Barrier Prediction on TorsionNet-500 (test)
0.04Energy MAEMatRIS-M
Evaluation results
| Method | Links | ||||
|---|---|---|---|---|---|
| MatRIS-MEvaluation Protocol=Zero-shot2026.03 | 0.04 | 0.07 | 0.07 | 0 | |
| DPA3-L24Evaluation Protocol=Zero-shot2026.03 | 0.06 | 0.09 | 0.09 | 0 | |
| MACE-OFF-LEvaluation Protocol=Zero-shot2026.03 | 0.14 | 0.21 | 0.23 | 4 | |
| DPA2-DrugEvaluation Protocol=Zero-shot2026.03 | 0.24 | 0.35 | 0.36 | 18 | |
| AIMNet2Evaluation Protocol=Zero-shot2026.03 | 0.38 | 0.55 | 0.58 | 82 |