File avogadro.spec of Package avogadro-qt4
#
# spec file for package avogadro
#
# Copyright (c) 2016 SUSE LINUX GmbH, Nuernberg, Germany.
#
# All modifications and additions to the file contributed by third parties
# remain the property of their copyright owners, unless otherwise agreed
# upon. The license for this file, and modifications and additions to the
# file, is the same license as for the pristine package itself (unless the
# license for the pristine package is not an Open Source License, in which
# case the license is the MIT License). An "Open Source License" is a
# license that conforms to the Open Source Definition (Version 1.9)
# published by the Open Source Initiative.
# Please submit bugfixes or comments via http://bugs.opensuse.org/
#
Name: avogadro-qt4
Version: 1.2.0
Release: 0
Summary: A Molecular design tool
License: GPL-2.0
Group: Productivity/Scientific/Chemistry
Url: http://avogadro.cc
Source0: http://sourceforge.net/projects/avogadro/files/avogadro/%{version}/avogadro-%{version}.tar.gz
Source1: avogadro.png
Source2: baselibs.conf
# PATCH-FIX-UPSTREAM avogadro-1.1.0-avopkg-fix-echo.patch ledest@gmail.com
Patch1: avogadro-1.1.0-avopkg-fix-echo.patch
Patch2: avogadro-boost.patch
Patch3: avogadro-opanbabel.patch
# PATCH-FIX-OPENSUSE don't use signbit() on non-float kkaempf@suse.de
Patch4: 0004-don-t-use-signbit-on-non-float.patch
# PATCH-FIX-OPENSUSE link with libm kkaempf@suse.de
Patch5: 0005-Link-with-libm.patch
# PATCH-FIX-UPSTREAM avogadro-port-to-eigen3.patch badshah400@gmail.com -- Cherry pick commits from upstream to get avogadro building with eigen3
Patch7: avogadro-port-to-eigen3.patch
%if 0%{?suse_version} >= 1500
BuildRequires: libboost_python-devel
%else
BuildRequires: boost-devel
%endif
BuildRequires: cmake
BuildRequires: docbook-utils
BuildRequires: fdupes
BuildRequires: gcc-c++
%if 0%{?suse_version} > 1500
# fails to build with latest glew, use an older one until it can be fixed
BuildRequires: glew2_1-devel
%else
BuildRequires: glew-devel
%endif
BuildRequires: libopenbabel-devel >= 2.3.1
BuildRequires: libqt4-devel >= 4.5.1
BuildRequires: python-devel
BuildRequires: python-numpy-devel
BuildRequires: python-qt4-devel
BuildRequires: python-sip-devel
BuildRequires: pkgconfig(eigen3)
BuildRequires: pkgconfig(glu)
BuildRequires: pkgconfig(gl)
BuildRequires: pkgconfig(x11)
BuildRequires: pkgconfig(zlib)
Requires: libavogadro1 = %{version}
Requires: openbabel
Requires: python-numpy
Requires: python-sip
Provides: avogadro = %{version}
Obsoletes: avogadro < 1.90
# libmsym.so
Conflicts: libmsym-devel
%description
Avogadro is an advanced molecular editor designed
for cross-platform use in computational chemistry,
molecular modeling, bioinformatics, materials science,
and related areas. It offers flexible rendering and
a powerful plugin architecture.
%package -n libavogadro1
Summary: A Molecular design tool
Group: Development/Libraries/C and C++
Provides: libavogadro = %{version}-%{release}
%description -n libavogadro1
This package contains the shared libraries for Avogadro.
Avogadro is an advanced molecular editor designed
for cross-platform use in computational chemistry,
molecular modeling, bioinformatics, materials science,
and related areas. It offers flexible rendering and
a powerful plugin architecture.
%package devel
Summary: Development files for Avogadro
Group: Development/Libraries/C and C++
Requires: %{name} = %{version}
Conflicts: libmsym-devel
%description devel
This package contains files to develop applications using
Avogadros libraries.
%package -n python-avogadro
Summary: A python wrapper to avogadro
Group: Development/Languages/Python
Requires: python-numpy
Requires: python-sip
%description -n python-avogadro
This package contains the python wrapper to Avogadro.
Avogadro is an advanced molecular editor designed
for cross-platform use in computational chemistry,
molecular modeling, bioinformatics, materials science,
and related areas. It offers flexible rendering and
a powerful plugin architecture.
%prep
%autosetup -p1 -n avogadro-%{version}
%build
%cmake \
-DBoost_NO_BOOST_CMAKE=ON \
-DINSTALL_LIB_DIR=%{_libdir} \
-DINSTALL_CMAKE_DIR=%{_libdir}/cmake/libmsym \
-DENABLE_GLSL=ON \
-DENABLE_UPDATE_CHECKER=OFF \
-DENABLE_ZMATRIX_TOOL=ON \
-DENABLE_PYTHON=ON \
-DPYTHON_EXECUTABLE=%{_bindir}/python2 \
-DCMAKE_BUILD_TYPE=RelWithDebInfo
%cmake_build
%install
%cmake_install
mkdir -p %{buildroot}/%{_datadir}/qt4/mkspecs/
mv %{buildroot}%{_prefix}/features %{buildroot}/%{_datadir}/qt4/mkspecs/
# Create the system menu entry
mkdir -p %{buildroot}%{_datadir}/applications
cat > %{buildroot}%{_datadir}/applications/avogadro.desktop << EOF
[Desktop Entry]
Name=Avogadro
Comment=%{summary}
GenericName=Avogadro
Exec=avogadro
Icon=avogadro
Terminal=0
Categories=KDE;Education;Chemistry;
Type=Application
X-SuSE-translate=false
EOF
# icon
install -D -m644 %{SOURCE1} %{buildroot}%{_datadir}/pixmaps/avogadro.png
%fdupes %{buildroot}%{_datadir}/libavogadro/shaders/
%fdupes %{buildroot}%{_datadir}/avogadro/
%post -n libavogadro1 -p /sbin/ldconfig
%postun -n libavogadro1 -p /sbin/ldconfig
%files
%doc AUTHORS README
%license COPYING
%{_mandir}/man1/avogadro.1.gz
%{_mandir}/man1/avopkg.1.gz
%{_bindir}/avogadro
%{_bindir}/avopkg
%{_bindir}/qube
%dir %{_datadir}/libavogadro
%{_datadir}/libavogadro/shaders/
%{_datadir}/avogadro
%{_datadir}/pixmaps/*.png
%{_datadir}/applications/avogadro.desktop
#plugins not libraries
%{_libdir}/libmsym.so
%dir %{_libdir}/avogadro
%dir %{_libdir}/avogadro/1_2
%dir %{_libdir}/avogadro/1_2/colors
%dir %{_libdir}/avogadro/1_2/engines
%dir %{_libdir}/avogadro/1_2/extensions
%dir %{_libdir}/avogadro/1_2/tools
%{_libdir}/avogadro/1_2/*/*.so
%dir %{_datadir}/libavogadro/engineScripts
%dir %{_datadir}/libavogadro/extensionScripts
%{_datadir}/libavogadro/engineScripts/wireframe.py
%{_datadir}/libavogadro/extensionScripts/example.py
%files devel
%dir %{_includedir}/avogadro
%{_includedir}/avogadro/*.h
%dir %{_includedir}/libmsym
%{_includedir}/libmsym/*.h
%dir %{_libdir}/cmake/libmsym
%{_libdir}/cmake/libmsym/*.cmake
%dir %{_libdir}/avogadro/1_2/cmake
%{_libdir}/libavogadro.so
%{_libdir}/libavogadro_OpenQube.so
%{_libdir}/avogadro/1_2/cmake/*
%{_libdir}/avogadro/1_2/*.cmake
%{_libdir}/avogadro/*.cmake
%{_libdir}/pkgconfig/*.pc
%{_datadir}/qt4/mkspecs/features/avogadro.prf
%files -n libavogadro1
%{_libdir}/*.so.*
%files -n python-avogadro
# installed with python support
%{python2_sitearch}/Avogadro.so
%changelog