PyCifRW~=4.4
aiida-core<3,>=2.0
aiidalab>=21.11.2
aiidalab-eln>=0.1.2,~=0.1
ansi2html~=1.6
ase~=3.18
bokeh~=2.0
humanfriendly~=10.0
ipytree~=0.2
ipywidgets~=7.7
more-itertools~=8.0
nglview~=3.0
optimade-client==2022.9.19
scikit-learn~=0.24
spglib~=1.14
vapory~=0.1.2

[dev]
bumpver==2021.1114
pre-commit==2.10.1
pytest~=6.0
pytest-docker~=1.0
pytest-selenium~=4.0
webdriver-manager~=3.8

[docs]
MarkupSafe<2.1
myst-nb
pydata-sphinx-theme
sphinx
sphinxcontrib-contentui
sphinxcontrib-details-directive
