ase
mpmath
numpy
optuna
scipy
pandas
tensorboard

[dev]
bump2version

[doc]
docutils==0.16
Sphinx==4.5.*
sphinx-rtd-theme==1.0.0
myst-parser==0.17.2
sphinx-markdown-tables==0.0.17

[experimental]
asap3
dftpy

[opt]
oapackage
pqkmeans

[test]
pytest
