scikit-learn==0.23.2
gensim==3.8.3
pandas==1.2.1
numpy==1.19.2
mol2vec==0.2.2
acm-hamburg-legacy>=0.2
nerdd-module>=0.1.0
chembl_structure_pipeline<1.2.0,>=1.0.0
setuptools<60.0

[dev]
mypy
isort
black

[test]
pytest
pytest-watch
pytest-cov
pytest-bdd
hypothesis
hypothesis-rdkit
