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| Dependency | Optional | Group |
|---|---|---|
| ase | false | |
| atomate2 | false | |
| azure-identity | false | |
| azure-storage-blob | false |
| Package | Optional | Group |
|---|---|---|
| matcalc | true | mattersim |
| mlipx | true | mattersim |
| torch-sim-atomistic | true | mattersim |
| deprecated | false |
| e3nn | false |
| loguru | false |
| mp-api | false |
| numpy | false |
| opt-einsum-fx | false |
| phono3py | false |
| phonopy | false |
| pydantic | false |
| pymatgen | false |
| scikit-learn | false |
| seekpath | false |
| torch | false |
| torch-ema | false |
| torch-geometric | false |
| torch-runstats | false |
| torch-sim-atomistic | false |
| torchaudio | false |
| torchmetrics | false |
| torchvision | false |
| typer | false |
| wandb | false |
| furo | true | docs |
| ipykernel | true | dev |
| ipython | true | dev |
| myst-parser | true | docs |
| nbconvert | true | docs |
| nbsphinx | true | docs |
| pre-commit | true | dev |
| pytest | true | dev |
| pytest-cov | true | dev |
| pytest-testmon | true | dev |
| sphinx | true | docs |
| sphinx-autodoc-typehints | true | docs |
| sphinx-copybutton | true | docs |
| sphinx-design | true | docs |