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| Dependency | Optional | Group |
|---|---|---|
| ase | false | |
| matplotlib | false | |
| numpy | false | |
| pandas | false |
| Package | Optional | Group |
|---|---|---|
| moyopy | true | bench |
| plotly | false |
| pymatgen | false |
| pymatviz | false |
| scikit-learn | false |
| scipy | false |
| seaborn | false |
| tqdm | false |
| wandb | false |
| alignn | true | running-models |
| chgnet | true | running-models |
| crystal-toolkit | true | 3d-structures |
| gdown | true | fetch-wbm-data |
| jarvis-tools | true | running-models |
| m3gnet | true | running-models |
| mace-torch | true | running-models |
| maml | true | running-models |
| megnet | true | running-models |
| pytest | true | test |
| pytest-cov | true | test |
| umap-learn | true | make-wbm-umap |