numpy>=1.20.0
biopython>=1.71
networkx>=2.0
GridDataFormats>=0.4.0
mmtf-python>=1.0.0
joblib>=0.12
scipy>=1.5.0
matplotlib>=1.5.1
tqdm>=4.43.0
packaging
fasteners
gsd>=1.9.3

[AMBER]
netCDF4>=1.0

[analysis]
seaborn
scikit-learn
tidynamics>=1.0.0

[extra_formats]
netCDF4>=1.0
h5py>=2.10
chemfiles>=0.10
