pymatgen~=2020.12.3
ase~=3.20
numeral~=0.1
apricot-select~=0.6
tqdm~=4.54
click~=7.1
pandas~=1.1
scikit-learn<0.23>=0.22
matminer<0.6.5
scikit-multilearn~=0.2
numba~=0.51

[dev]
pre-commit~=2.6.0
pylint~=2.5.3
pytest~=6.0.1
versioneer~=0.18
isort~=4.3.21
black

[docs]
sphinx~=3.3.1
sphinx-book-theme~=0.0.39
sphinx-autodoc-typehints~=1.11.1
sphinx-copybutton~=0.3.1
