## START: Set by rpmautospec
## (rpmautospec version 0.8.4)
## RPMAUTOSPEC: autorelease, autochangelog
%define autorelease(e:s:pb:n) %{?-p:0.}%{lua:
    release_number = 2;
    base_release_number = tonumber(rpm.expand("%{?-b*}%{!?-b:1}"));
    print(release_number + base_release_number - 1);
}%{?-e:.%{-e*}}%{?-s:.%{-s*}}%{!?-n:%{?dist}}
## END: Set by rpmautospec

%global soversion 0

Name:           mctc-lib
Version:        0.5.2
Release:        %autorelease
Summary:        Modular computation tool chain library
License:        Apache-2.0
URL:            https://grimme-lab.github.io/mctc-lib/
Source0:        https://github.com/grimme-lab/mctc-lib/archive/v%{version}/%{name}-%{version}.tar.gz

BuildRequires:  gcc-gfortran
BuildRequires:  cmake
BuildRequires:  cmake(jonquil)
BuildRequires:  cmake(toml-f)
# For docs
BuildRequires:  rubygem-asciidoctor

%description
Common tool chain for working with molecular structure data in various
applications. This library provides a unified way to perform
operations on molecular structure data, like reading and writing to
common geometry file formats.

%package        devel
Summary:        Development files for %{name}
Requires:       %{name}%{?_isa} = %{version}-%{release}

%description    devel
The %{name}-devel package contains libraries and header files for
developing applications that use %{name}.

%prep
%autosetup -p1


%conf
# TODO: Account for absolute path CMAKE_INSTALL_INCLUDEDIR so we can use %%{_fmoddir}
%cmake \
  -DCMAKE_INSTALL_INCLUDEDIR:PATH=%{_lib}/gfortran/modules \
  -Dmctc-lib-module-dir:STRING=mctc-lib \
  -DMCTCLIB_WITH_OpenMP:BOOL=ON \
  -DMCTCLIB_WITH_JSON:BOOL=ON


%build
%cmake_build


%install
%cmake_install


%check
%ctest


%files
%license LICENSE
%doc README.md
%{_bindir}/mctc-convert
%{_libdir}/libmctc-lib.so.%{soversion}{,.*}

%files devel
%{_fmoddir}/mctc-lib/
%{_libdir}/cmake/mctc-lib/
%{_libdir}/pkgconfig/mctc-lib.pc
%{_libdir}/libmctc-lib.so


%changelog
## START: Generated by rpmautospec
* Mon Jul 27 2026 Cristian Le <git@lecris.dev> - 0.5.2-2
- Switch to using CMake build system and minor cleanup

* Mon Jul 27 2026 Cristian Le <git@lecris.dev> - 0.5.2-1
- Update to 0.5.2 (rhbz#2357058)

* Thu Jul 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.2-5
- Rebuilt for https://fedoraproject.org/wiki/Fedora_45_Mass_Rebuild

* Fri Jan 16 2026 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.2-4
- Rebuilt for https://fedoraproject.org/wiki/Fedora_44_Mass_Rebuild

* Thu Jul 24 2025 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.2-3
- Rebuilt for https://fedoraproject.org/wiki/Fedora_43_Mass_Rebuild

* Fri Jan 17 2025 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.2-2
- Rebuilt for https://fedoraproject.org/wiki/Fedora_42_Mass_Rebuild

* Fri Sep 06 2024 Susi Lehtola <jussilehtola@fedoraproject.org> - 0.3.2-1
- Update to 0.3.2.

* Wed Jul 24 2024 Miroslav Suchý <msuchy@redhat.com> - 0.3.0-10
- convert license to SPDX

* Thu Jul 18 2024 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.0-9
- Rebuilt for https://fedoraproject.org/wiki/Fedora_41_Mass_Rebuild

* Thu Jan 25 2024 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.0-8
- Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild

* Sun Jan 21 2024 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.0-7
- Rebuilt for https://fedoraproject.org/wiki/Fedora_40_Mass_Rebuild

* Thu Jul 20 2023 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.0-6
- Rebuilt for https://fedoraproject.org/wiki/Fedora_39_Mass_Rebuild

* Thu Jan 19 2023 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.0-5
- Rebuilt for https://fedoraproject.org/wiki/Fedora_38_Mass_Rebuild

* Thu Jul 21 2022 Fedora Release Engineering <releng@fedoraproject.org> - 0.3.0-4
- Rebuilt for https://fedoraproject.org/wiki/Fedora_37_Mass_Rebuild

* Wed Jun 15 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 0.3.0-3
- Use %%{_fmoddir} in spec.

* Thu Jun 09 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 0.3.0-2
- Fix build in mock.

* Tue May 24 2022 Susi Lehtola <jussilehtola@fedoraproject.org> - 0.3.0-1
- Initial release.

## END: Generated by rpmautospec