numpy>=1.26.0
GridDataFormats>=0.4.0
mmtf-python>=1.0.0
joblib>=0.12
scipy>=1.5.0
matplotlib>=1.5.1
tqdm>=4.43.0
threadpoolctl
packaging
filelock
mda-xdrlib

[analysis]
biopython>=1.80
seaborn
scikit-learn
tidynamics>=1.0.0
networkx>=2.0
waterdynamics
pathsimanalysis
mdahole2

[doc]
sphinx
sphinx-sitemap
mdanalysis-sphinx-theme>=1.3.0
sphinxcontrib-bibtex
pybtex
pybtex-docutils

[extra_formats]
netCDF4>=1.0
h5py>=2.10
chemfiles>=0.10
parmed
pyedr>=0.7.0
pytng>=0.2.3
gsd>3.0.0
rdkit>=2022.09.1
imdclient>=0.2.2

[parallel]
dask
