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Dependencies
- chemparse >=0.1.0
- compress-pickle >=2.1.0
- joblib >=1.5.0
- lightning >=2.1.0
- lmfit >=1.2.0
- onnxruntime >=1.23
- pandas >=2.0.0
- platformdirs >=4.5.1
- requests >=2.30.0
- scikit-learn >=1.5.0
- torch >=2.0.0
3 optional dependencies
- nbsphinx[docs]
- sphinx[docs]
- sphinx-rtd-theme[docs]