Name:           python-pymatgen
Version:        2026.10.24
Release:        %autorelease
# Fill in the actual package summary to submit package to Fedora
Summary:        Python Materials Genomics is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project _https://materialsproject.org_.

# Check if the automatically generated License and its spelling is correct for Fedora
# https://docs.fedoraproject.org/en-US/packaging-guidelines/LicensingGuidelines/
License:        MIT
URL:            https://pymatgen.org
Source:         %{pypi_source pymatgen}

BuildArch:      noarch
BuildRequires:  python3-devel


# Fill in the actual package description to submit package to Fedora
%global _description %{expand:
This is package 'pymatgen' generated automatically by pyp2spec.}

%description %_description

%package -n     python3-pymatgen
Summary:        %{summary}

%description -n python3-pymatgen %_description

# For official Fedora packages, review which extras should be actually packaged
# See: https://docs.fedoraproject.org/en-US/packaging-guidelines/Python/#Extras
%pyproject_extras_subpkg -n python3-pymatgen abinit,ase,matcalc,mlp,numba,numpy-v1,optional,prototypes,symmetry,tblite,vis,zeopp


%prep
%autosetup -p1 -n pymatgen-%{version}


%generate_buildrequires
# Keep only those extras which you actually want to package or use during tests
%pyproject_buildrequires -x abinit,ase,matcalc,mlp,numba,numpy-v1,optional,prototypes,symmetry,tblite,vis,zeopp


%build
%pyproject_wheel


%install
%pyproject_install
# For official Fedora packages, including files with '*' +auto is not allowed
# Replace it with a list of relevant Python modules/globs and list extra files in %%files
%pyproject_save_files '*' +auto


%check
%_pyproject_check_import_allow_no_modules -t


%files -n python3-pymatgen -f %{pyproject_files}
%{_bindir}/feff_plot_cross_section
%{_bindir}/feff_plot_dos
%{_bindir}/get_environment
%{_bindir}/pmg


%changelog
%autochangelog