SPICE
Benchmarks
| Task Name | Dataset Name | SOTA Result | Trend | |
|---|---|---|---|---|
| Energy and Force Prediction | SPICE QMugs (test) | Energy MAE (meV/atom)0.11 | 6 | |
| Energy and Force Prediction | SPICE Water (test) | Energy MAE (meV/atom)0.08 | 6 | |
| Energy and Force Prediction | SPICE Solvated Amino Acids (test) | Energy MAE (meV/atom)0.13 | 6 | |
| Energy and Force Prediction | SPICE Dipeptides (test) | Energy/Atom MAE (meV)0.06 | 6 | |
| Energy and Force Prediction | SPICE DES370K Dimers (test) | Energy MAE / Atom (meV)0.06 | 6 | |
| Energy and Force Prediction | SPICE DES370K Monomers (test) | Energy/Atom MAE (meV)0.07 | 6 | |
| Energy and Force Prediction | SPICE PubChem (test) | Energy MAE (meV/atom)0.13 | 6 | |
| Knowledge Base Question Answering | SPICE (test) | m-F1 (Logical Reasoning)89.61 | 5 |
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