gemmi>=0.6
jax>=0.4
networkx>=3.0
numpy>=1.24
pandas>=2.0
scipy>=1.10
tqdm>=4.65

[all]
MDAnalysis>=2.6
mdtraj>=1.9
numba>=0.59
ijson>=3.2
msgspec>=0.18
matplotlib>=3.7
python-dateutil>=2.8

[dev]
build>=1.0
pytest>=8.0
twine>=5.0

[docs]
sphinx>=8
