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Dependencies
- allpairspy <3.0.0,>=2.5.0
- ase <4.0.0,>=3.22.1
- cloudpickle <3.0.0,>=2.2.0
- dpdata ==0.2.18
- fabric <3.0.0,>=2.7.1
- fire <0.6.0,>=0.5.0
- invoke <2.0.0,>=1.7.3
- joblib <2.0.0,>=1.2.0
- mdanalysis <3.0.0,>=2.4.3
- netcdf4 <2.0.0,>=1.7.1.post1
- numpy ==1.24.3
- oh-my-batch >=0.7.0
- pandas <2.0.0,>=1.5.3
- psutil <6.0.0,>=5.9.8
- pydantic ==2.8.2
- ruamel-yaml <0.18.0,>=0.17.21
- scikit-learn <2.0.0,>=1.6.1
- scipy <2.0.0,>=1.13.0
- shortuuid <2.0.0,>=1.0.11
- tabulate <0.10.0,>=0.9.0
5 optional dependencies
- asaplib[all]
- dscribe[all]
- fire-rpc[all]
- ipympl[all]
- jupyter-formily[all]