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29 commits

Author SHA1 Message Date
Christoph Junghans
e3772f577b Replaced by 'votca' package 2022-01-12 19:34:58 -07:00
Christoph Junghans
e5ad274dbe fix deps again 2021-12-01 09:10:59 -07:00
Christoph Junghans
dfd1568284 added missing dep 2021-11-30 17:54:39 -07:00
Christoph Junghans
ed60d64449 Version bump to 2022-rc.1 2021-11-30 17:03:02 -07:00
Orion Poplawski
e6557125fb Rebuild for hdf5 1.12.1 2021-11-20 21:43:19 -07:00
Christoph Junghans
52fdf03077 version bump to v2021.2 (bug #2005701) 2021-09-20 06:01:00 -06:00
Orion Poplawski
dd735a292e Rebuild for hdf5 1.10.7 2021-08-09 20:16:01 -06:00
Jonathan Wakely
fa45edc45c Rebuilt for Boost 1.76 2021-08-07 05:42:24 +01:00
Fedora Release Engineering
97bb12683a - Rebuilt for https://fedoraproject.org/wiki/Fedora_35_Mass_Rebuild
Signed-off-by: Fedora Release Engineering <releng@fedoraproject.org>
2021-07-23 20:40:15 +00:00
Christoph Junghans
d51511962e Version bump to v2021.1 (bug #1983383) 2021-07-18 09:22:59 -06:00
Christoph Junghans
50c1d76490 Version bump to v2021 (bug #1938406) 2021-03-13 14:04:38 -07:00
Fedora Release Engineering
34f1a71c49 - Rebuilt for https://fedoraproject.org/wiki/Fedora_34_Mass_Rebuild
Signed-off-by: Fedora Release Engineering <releng@fedoraproject.org>
2021-01-27 23:14:51 +00:00
Jonathan Wakely
eaf7c6b750 Rebuilt for Boost 1.75 2021-01-22 21:03:45 +00:00
Christoph Junghans
64a1bfdb2f Version bump to 2021~rc1 (bug #1916970) 2021-01-21 21:29:24 -07:00
Christoph Junghans
14a7ecc09b Version bump to v1.6.4 (bug #1915546) 2021-01-12 15:12:32 -07:00
Christoph Junghans
85a3e82006 Version bump to 1.6.3 (bug #1905887) 2020-12-09 18:53:53 -07:00
Christoph Junghans
0755c85dea Version bump to v1.6.2 (bug #1871343) 2020-08-22 13:59:35 -06:00
Christoph Junghans
e50c4b4ca0 Fix out-of-source build on F33 (bug#1865611) 2020-08-04 07:19:00 -06:00
Fedora Release Engineering
db71caabf2 - Second attempt - Rebuilt for https://fedoraproject.org/wiki/Fedora_33_Mass_Rebuild
Signed-off-by: Fedora Release Engineering <releng@fedoraproject.org>
2020-08-01 09:36:48 +00:00
Fedora Release Engineering
3b5387a194 - Rebuilt for https://fedoraproject.org/wiki/Fedora_33_Mass_Rebuild
Signed-off-by: Fedora Release Engineering <releng@fedoraproject.org>
2020-07-29 13:53:17 +00:00
Orion Poplawski
a3ab7d17e4 Rebuild for hdf5 1.10.6 2020-06-25 14:31:02 -06:00
Christoph Junghans
364fc37cc6 Version bump to v1.6.1 2020-06-21 11:53:56 -06:00
Jonathan Wakely
8155b37361 Rebuilt for Boost 1.73 2020-05-30 10:09:09 +01:00
Christoph Junghans
ea725e1a3b remove obsolete patch 2020-04-18 11:04:29 -06:00
Christoph Junghans
cced478e0b Version bump to v1.6 (bug #1825475) 2020-04-18 07:58:46 -06:00
Christoph Junghans
753d8b403e Version bump to 1.6~rc2 2020-02-10 18:05:41 -07:00
Fedora Release Engineering
ff9e851d28 - Rebuilt for https://fedoraproject.org/wiki/Fedora_32_Mass_Rebuild
Signed-off-by: Fedora Release Engineering <releng@fedoraproject.org>
2020-01-31 03:23:15 +00:00
Christoph Junghans
ea5a8cc7b6 fix 32bit builds 2019-12-13 15:23:44 -07:00
Christoph Junghans
4a67a87cd1 Version bump to 1.6_rc1 (bug #1779897) 2019-12-05 14:06:00 -07:00
4 changed files with 1 additions and 203 deletions

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/votca-xtp*.src.rpm
/votca-xtp-1.4_rc1.tar.gz
/votca-xtp-manual-1.4_rc1.pdf
/votca-xtp-1.4.tar.gz
/votca-xtp-manual-1.4.pdf
/votca-xtp-manual-1.4.1.pdf
/votca-xtp-1.4.1.tar.gz
/votca-xtp-1.5.tar.gz
/votca-xtp-manual-1.5.pdf
/votca-xtp-manual-1.5.1.pdf
/votca-xtp-1.5.1.tar.gz

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dead.package Normal file
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Replaced by 'votca' package

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SHA512 (votca-xtp-manual-1.5.1.pdf) = b410ddad0566933a2c9ad386fb6f4df0e71b316a84bce8c841e94df8f438959f0967ade63d1146549d453c2ecdb48e3d8b1fd147e53888e1717c6db3d07ba061
SHA512 (votca-xtp-1.5.1.tar.gz) = 8fb6891e84d4d685e26287344554b705c607e7cb9f497c00ac9cd8328e50210c56706abdb7004b83d4addbfbc7b35c3526b4feabf75f681362b3b7a39c54b668

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#global _rcname rc1
#global _rc _%%_rcname
Name: votca-xtp
Version: 1.5.1
Release: 1%{?_rcname}%{?dist}
Summary: VOTCA excitation and charge properties module
License: ASL 2.0
URL: http://www.votca.org
Source0: https://github.com/votca/xtp/archive/v%{version}%{?_rc}.tar.gz#/%{name}-%{version}%{?_rc}.tar.gz
Source1: https://github.com/votca/xtp/releases/download/v%{version}%{?_rc}/votca-xtp-manual-%{version}%{?_rc}.pdf
BuildRequires: gcc-c++
BuildRequires: cmake3
BuildRequires: eigen3-devel
BuildRequires: libxc-devel
BuildRequires: ceres-solver-devel
BuildRequires: hdf5-devel
BuildRequires: pkgconfig
BuildRequires: boost-devel
BuildRequires: votca-csg-devel = %{version}
Requires: %{name}-common = %{version}-%{release}
Requires: %{name}-libs%{_isa} = %{version}-%{release}
%description
Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
a package intended to reduce the amount of routine work when doing systematic
coarse-graining of various systems. The core is written in C++.
This package contains the excitation and charge properties module of VOTCA
package.
%package libs
Summary: Libraries for VOTCA excitation and charge properties module
%description libs
Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
a package intended to reduce the amount of routine work when doing systematic
coarse-graining of various systems. The core is written in C++.
This package contains libraries for the excitation and charge properties
module of VOTCA package.
%package devel
Summary: Development headers and libraries for VOTCA XTP
Requires: %{name}-libs%{_isa} = %{version}-%{release}
Requires: votca-csg-devel%{_isa} = %{version}
%description devel
Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
a package intended to reduce the amount of routine work when doing systematic
coarse-graining of various systems. The core is written in C++.
This package contains development headers and libraries for the excitation and
charge properties module.
%package common
Summary: Architecture independent data files for VOTCA XTP
BuildArch: noarch
%description common
Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
a package intended to reduce the amount of routine work when doing systematic
coarse-graining of various systems. The core is written in C++.
This package contains architecture independent data files for VOTCA XTP.
%package doc
Summary: Architecture independent doc files for VOTCA XTP
BuildArch: noarch
Requires: votca-csg-common = %{version}
%description doc
Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
a package intended to reduce the amount of routine work when doing systematic
coarse-graining of various systems. The core is written in C++.
This package contains architecture independent documentation for VOTCA XTP.
%prep
%setup -qn xtp-%{version}%{?_rc}
%if 0%{?rhel}
sed -i '/Boost/s/1.57.0/1.53.0/' src/tests/CMakeLists.txt CMakeLists.txt
%endif
%build
mkdir %{_target_platform}
pushd %{_target_platform}
%if 0%{?rhel}
export CXXFLAGS="%optflags -DBOOST_NO_CXX11_SCOPED_ENUMS"
%endif
%{cmake3} .. -DCMAKE_BUILD_TYPE=Release -DENABLE_TESTING=ON
%make_build
%install
%make_install -C%{_target_platform}
sed -i -e '1s@env @@' %{buildroot}/%{_bindir}/xtp_*
mkdir -p %{buildroot}%{_docdir}/%{name}
cp %{S:1} %{buildroot}%{_docdir}/%{name}
%check
%if 0%{?rhel}
# some bug in old boost regex
%global testargs ARGS='-E \\(unit_test_espfit\\|unit_test_orbitals\\|unit_test_qmstate\\)'
%ifarch ppc64le
# Boost testing broken on ppc64le
%global testargs ARGS='-E .'
%endif
%endif
make -C %{_target_platform} test CTEST_OUTPUT_ON_FAILURE=1 %{?testargs:%{testargs}}
%ldconfig_scriptlets libs
%files
%{_bindir}/xtp_*
%files doc
%doc CHANGELOG.md NOTICE README.md
%license LICENSE.md
%{_docdir}/%{name}
%files common
%license LICENSE.md
%{_datadir}/votca/xtp
%files libs
%license LICENSE.md
%{_libdir}/libvotca_xtp.so.*
%files devel
%{_includedir}/votca/xtp/
%{_libdir}/libvotca_xtp.so
%{_libdir}/pkgconfig/libvotca_xtp.pc
%changelog
* Fri Nov 22 2019 Christoph Junghans <junghans@votca.org> - 1.5.1-1
- Version bump to 1.5.1 (bug #1774855)
* Sat Jul 27 2019 Fedora Release Engineering <releng@fedoraproject.org> - 1.5-1.3
- Rebuilt for https://fedoraproject.org/wiki/Fedora_31_Mass_Rebuild
* Tue Mar 12 2019 Orion Poplawski <orion@nwra.com> - 1.5-1.2
- Rebuild for hdf5 1.10.5
* Sun Feb 03 2019 Fedora Release Engineering <releng@fedoraproject.org> - 1.5-1.1
- Rebuilt for https://fedoraproject.org/wiki/Fedora_30_Mass_Rebuild
* Sat Feb 02 2019 Christoph Junghans <junghans@votca.org> - 1.5-1
- Version bump to v1.5 (bug #1667602)
- drop 55.patch, merged upstream
- Fix FTBFS (bug #1606654)
* Sat Jul 14 2018 Fedora Release Engineering <releng@fedoraproject.org> - 1.4.1-1.3
- Rebuilt for https://fedoraproject.org/wiki/Fedora_29_Mass_Rebuild
* Fri Feb 09 2018 Fedora Release Engineering <releng@fedoraproject.org> - 1.4.1-1.2
- Rebuilt for https://fedoraproject.org/wiki/Fedora_28_Mass_Rebuild
* Wed Jan 31 2018 Christoph Junghans <junghans@votca.org> - 1.4.1-1.1
- Rebuilt for Boost 1.66
- Add 55.patch
* Sun Sep 03 2017 Christoph Junghans <junghans@votca.org> - 1.4.1-1
- Update to 1.4.1 (#1487881)
* Thu Aug 03 2017 Fedora Release Engineering <releng@fedoraproject.org> - 1.4-2.4
- Rebuilt for https://fedoraproject.org/wiki/Fedora_27_Binutils_Mass_Rebuild
* Thu Jul 27 2017 Fedora Release Engineering <releng@fedoraproject.org> - 1.4-2.3
- Rebuilt for https://fedoraproject.org/wiki/Fedora_27_Mass_Rebuild
* Mon Jul 24 2017 Björn Esser <besser82@fedoraproject.org> - 1.4-2.2
- Rebuilt for Boost 1.64
* Mon May 15 2017 Fedora Release Engineering <rel-eng@lists.fedoraproject.org> - 1.4-2.1
- Rebuilt for https://fedoraproject.org/wiki/Fedora_26_27_Mass_Rebuild
* Tue Feb 07 2017 Kalev Lember <klember@redhat.com> - 1.4-2
- Rebuilt for Boost 1.63
* Sun Oct 30 2016 Christoph Junghans <junghans@votca.org> - 1.4-1
- Update to 1.4
* Mon Oct 03 2016 Christoph Junghans <junghans@votca.org> - 1.4-0.2rc1
- Changes from review (bug #1380540)
* Wed Sep 28 2016 Christoph Junghans <junghans@votca.org> - 1.4-0.1rc1
- Imported 1.4_rc1