ISO17
Benchmarks
| Task Name | Dataset Name | SOTA Result | Trend | |
|---|---|---|---|---|
| Molecular energy and force prediction | ISO17 (unknown molecules unknown conformation) | Energy MAE (kcal/mol)2.4 | 6 | |
| Molecular energy and force prediction | ISO17 known molecules unknown conformation | Energy MAE (kcal/mol)0.1 | 6 |
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