Metadata-Version: 2.1
Name: deepmol
Version: 0.0.2b0
Summary: DeepMol: a python-based machine and deep learning framework for drug discovery
Home-page: UNKNOWN
Author: DeepMol Team
License: BSD 2-Clause License
Keywords: machine-learning,deep-learning,cheminformatics,drug-discovery
Platform: unix
Platform: linux
Platform: osx
Platform: cygwin
Platform: win32
Classifier: Programming Language :: Python :: 3 :: Only
Requires-Python: >=3.7
License-File: LICENSE
Requires-Dist: rdkit-pypi (==2022.3.5)
Requires-Dist: smilespe (==0.0.3)
Requires-Dist: seaborn (==0.12.0)
Requires-Dist: joblib (==1.1.0)
Requires-Dist: pillow (==8.4.0)
Requires-Dist: h5py (==3.1.0)
Requires-Dist: shap (==0.41.0)
Provides-Extra: deep_learning
Requires-Dist: torch (==1.12.1) ; extra == 'deep_learning'
Requires-Dist: torchvision (==0.13.1) ; extra == 'deep_learning'
Requires-Dist: torchaudio (==0.12.1) ; extra == 'deep_learning'
Requires-Dist: dgl (==0.9.1) ; extra == 'deep_learning'
Requires-Dist: deepchem (==2.5.0) ; extra == 'deep_learning'
Requires-Dist: tensorflow (==2.10.0) ; extra == 'deep_learning'
Provides-Extra: machine_learning
Requires-Dist: boruta (==0.3) ; extra == 'machine_learning'
Provides-Extra: preprocessing
Requires-Dist: gensim (==4.2.0) ; extra == 'preprocessing'
Provides-Extra: testing
Requires-Dist: pytest (>=7.1.1) ; extra == 'testing'
Requires-Dist: pytest-cov (>=3.0.0) ; extra == 'testing'
Requires-Dist: mypy (>=0.942) ; extra == 'testing'
Requires-Dist: flake8 (>=4.0.1) ; extra == 'testing'
Requires-Dist: tox (>=3.25.0) ; extra == 'testing'

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