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Dependencies
- chemiscope <0.7.0,>=0.6.0
- deepmd-kit <3.0.0,>=2.2.7
- dpdata <0.3.0,>=0.2.17
- dscribe <3.0.0,>=2.1.0
- parsl <2024.0.0,>=2023.03.13
- pymatgen <2024.0.0,>=2023.11.12
- rdkit <2024.0.0,>=2023.9.2
- scikit-learn <2.0.0,>=1.3.2
- seaborn <0.14.0,>=0.13.0
- skmatter <0.3.0,>=0.2.0