ncrystal-core==4.0.0
ncrystal-python==4.0.0

[all]
ase<3.24.0
gemmi
spglib
matplotlib

[cif]
ase<3.24.0
gemmi
spglib

[composer]
spglib

[devel]
simple-build-system>=1.6.0
ruff>=0.8.0
pyyaml
cppcheck
mpmath
tomli
pybind11

[plot]
matplotlib
