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Dependencies
- ase >=3.24.0
- clu >=0.0.12
- e3x >=1.0.2
- einops >=0.8.0
- flax >=0.10.6
- jax >=0.7.0
- lazy-loader >=0.4
- numpy >=2.0.0
- optax >=0.2.4
- orbax-checkpoint >=0.11.0
- pydantic >=2.10.5
- tensorflow >=2.18.0
- typer >=0.13.0
- uncertainty-toolbox >=0.1.1
- vesin >=0.3.0
- znh5md >=0.4.8
17 optional dependencies
- docutils[docs]
- furo[docs]
- ipsuite[ipsuite]
- ipykernel[docs]
- jax[cuda]
- mlflow[mlflow]
- myst-parser[docs]
- nbsphinx[docs]
- nbsphinx-link[docs]
- openmm[openmm]
- optuna[optuna]
- optunahub[optuna]
- pandoc[docs]
- sphinx[docs]
- sphinx-copybutton[docs]
- sphinx-rtd-theme[docs]
- umap-learn[umap]