ipython
jupyterlab
ipywidgets
clease>=0.11.5
pandas
numpy
matplotlib
click>=8.0.0
ase
nglview
packaging

[all]
sphinx
pytest>=4
pylint
pytest-mock
sphinx_rtd_theme
tox
pre-commit
black[jupyter]
build
flake8
twine
pyclean>=2.0.0

[dev]
pre-commit
black[jupyter]
flake8
pylint
tox

[doc]
sphinx
sphinx_rtd_theme

[publish]
pyclean>=2.0.0
twine
build

[test]
pytest>=4
pytest-mock
