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1 commit
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e3772f577b |
4 changed files with 1 additions and 265 deletions
23
.gitignore
vendored
23
.gitignore
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/votca-xtp*.src.rpm
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/votca-xtp-1.4_rc1.tar.gz
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/votca-xtp-manual-1.4_rc1.pdf
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/votca-xtp-1.4.tar.gz
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/votca-xtp-manual-1.4.pdf
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/votca-xtp-manual-1.4.1.pdf
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/votca-xtp-1.4.1.tar.gz
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/votca-xtp-1.5.tar.gz
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/votca-xtp-manual-1.5.pdf
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/votca-xtp-manual-1.5.1.pdf
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/votca-xtp-1.5.1.tar.gz
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/votca-xtp-1.6_rc1.tar.gz
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/votca-xtp-1.6_rc2.tar.gz
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/votca-xtp-1.6.tar.gz
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/votca-xtp-1.6.1.tar.gz
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/votca-xtp-1.6.2.tar.gz
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/votca-xtp-1.6.3.tar.gz
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/votca-xtp-1.6.4.tar.gz
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/votca-xtp-2021-rc.1.tar.gz
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/votca-xtp-2021.tar.gz
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/votca-xtp-2021.1.tar.gz
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/votca-xtp-2021.2.tar.gz
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/votca-2022-rc.1.tar.gz
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1
dead.package
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1
dead.package
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Replaced by 'votca' package
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1
sources
1
sources
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SHA512 (votca-2022-rc.1.tar.gz) = 46a9dbbac663f3e3cceeb5803af108d623a1774d916347c9e6e8cbcbd05297d980132a4ee4508c42e98e567ca8bd38f301aeab4a3bf2f3dcf056333dbe667c97
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241
votca-xtp.spec
241
votca-xtp.spec
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Name: votca-xtp
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Version: 2022~rc1
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%global uversion 2022-rc.1
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%global sover 2022
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Release: 1%{?dist}
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Summary: VOTCA excitation and charge properties module
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License: ASL 2.0
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URL: http://www.votca.org
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Source0: https://github.com/votca/votca/archive/v%{uversion}.tar.gz#/votca-%{uversion}.tar.gz
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BuildRequires: gcc-c++
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BuildRequires: cmake3
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BuildRequires: eigen3-devel
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BuildRequires: libxc-devel
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BuildRequires: hdf5-devel
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BuildRequires: fftw-devel
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BuildRequires: pkgconfig
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BuildRequires: boost-devel
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BuildRequires: libint2-devel
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BuildRequires: libecpint-devel
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BuildRequires: votca-csg-devel = %{version}
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BuildRequires: votca-csg = %{version}
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Requires: %{name}-common = %{version}-%{release}
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Requires: %{name}-libs%{_isa} = %{version}-%{release}
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# https://github.com/votca/xtp/issues/652
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ExcludeArch: %ix86 %arm
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%description
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Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
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a package intended to reduce the amount of routine work when doing systematic
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coarse-graining of various systems. The core is written in C++.
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This package contains the excitation and charge properties module of VOTCA
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package.
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%package libs
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Summary: Libraries for VOTCA excitation and charge properties module
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%description libs
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Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
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a package intended to reduce the amount of routine work when doing systematic
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coarse-graining of various systems. The core is written in C++.
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This package contains libraries for the excitation and charge properties
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module of VOTCA package.
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%package devel
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Summary: Development headers and libraries for VOTCA XTP
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Requires: %{name}-libs%{_isa} = %{version}-%{release}
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Requires: votca-csg-devel%{_isa} = %{version}
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%description devel
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Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
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a package intended to reduce the amount of routine work when doing systematic
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coarse-graining of various systems. The core is written in C++.
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This package contains development headers and libraries for the excitation and
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charge properties module.
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%package common
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Summary: Architecture independent data files for VOTCA XTP
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BuildArch: noarch
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%description common
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Versatile Object-oriented Toolkit for Coarse-graining Applications (VOTCA) is
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a package intended to reduce the amount of routine work when doing systematic
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coarse-graining of various systems. The core is written in C++.
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This package contains architecture independent data files for VOTCA XTP.
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%prep
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%setup -qn votca-%{uversion}
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%build
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%global _vpath_srcdir xtp
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%{cmake3} -DCMAKE_BUILD_TYPE=Release -DENABLE_TESTING=ON
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%cmake_build
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%install
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%cmake_install
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%check
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%ctest
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%ldconfig_scriptlets libs
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%files
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%doc CHANGELOG.rst xtp/NOTICE.rst README.rst
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%{_bindir}/xtp_*
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%{_mandir}/man1/xtp_*.1.*
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%files common
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%license xtp/LICENSE.rst
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%{_datadir}/votca/xtp
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%files libs
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%license xtp/LICENSE.rst
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%{_libdir}/libvotca_xtp.so.%{sover}
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%files devel
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%{_includedir}/votca/xtp/
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%{_libdir}/libvotca_xtp.so
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%{_libdir}/cmake/VOTCA_XTP
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%changelog
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* Tue Nov 30 2021 Christoph Junghans <junghans@votca.org> - 2022~rc1-1
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- Version bump to 2022-rc.1
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* Sun Nov 21 2021 Orion Poplawski <orion@nwra.com> - 2021.2-2
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- Rebuild for hdf5 1.12.1
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* Mon Sep 20 2021 Christoph Junghans <junghans@votca.org> - 2021.2-1
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- version bump to v2021.2 (bug #2005701)
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* Tue Aug 10 2021 Orion Poplawski <orion@nwra.com> - 2021.1-4
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- Rebuild for hdf5 1.10.7
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* Sat Aug 07 2021 Jonathan Wakely <jwakely@redhat.com> - 2021.1-3
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- Rebuilt for Boost 1.76
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* Fri Jul 23 2021 Fedora Release Engineering <releng@fedoraproject.org> - 2021.1-2
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_35_Mass_Rebuild
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* Sun Jul 18 2021 Christoph Junghans <junghans@votca.org> - 2021.1-1
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- Version bump to v2021.1 (bug #1983383)
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* Sat Mar 13 2021 Christoph Junghans <junghans@votca.org> - 2021-1
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- Version bump to v2021 (bug #1938406)
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* Wed Jan 27 2021 Fedora Release Engineering <releng@fedoraproject.org> - 2021~rc1-3
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_34_Mass_Rebuild
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* Fri Jan 22 2021 Jonathan Wakely <jwakely@redhat.com> - 2021~rc1-2
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- Rebuilt for Boost 1.75
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* Thu Jan 21 17:10:34 MST 2021 Christoph Junghans <junghans@lanl.gov> - 2021~rc1-1
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- Version bump to 2021~rc1 (bug #1916970)
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* Tue Jan 12 15:04:24 MST 2021 Christoph Junghans <junghans@lanl.gov> - 1.6.4-1
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- Version bump to v1.6.4 (bug #1915546)
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* Wed Dec 9 18:52:59 MST 2020 Christoph Junghans <junghans@votca.org> - 1.6.3-1
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- Version bump to 1.6.3 (bug #1905887)
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* Sat Aug 22 2020 Christoph Junghans <junghans@votca.org> - 1.6.2-1
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- Version bump to v1.6.2 (bug #1871343)
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* Tue Aug 04 2020 Christoph Junghans <junghans@votca.org> - 1.6.1-5
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- Fix out-of-source build on F33 (bug#1865611)
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* Sat Aug 01 2020 Fedora Release Engineering <releng@fedoraproject.org> - 1.6.1-4
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- Second attempt - Rebuilt for
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https://fedoraproject.org/wiki/Fedora_33_Mass_Rebuild
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* Wed Jul 29 2020 Fedora Release Engineering <releng@fedoraproject.org> - 1.6.1-3
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_33_Mass_Rebuild
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* Thu Jun 25 2020 Orion Poplawski <orion@cora.nwra.com> - 1.6.1-2
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- Rebuild for hdf5 1.10.6
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* Sun Jun 21 2020 Christoph Junghans <junghans@votca.org> - 1.6.1-1
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- Version bump to v1.6.1
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* Sat May 30 2020 Jonathan Wakely <jwakely@redhat.com> - 1.6-2
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- Rebuilt for Boost 1.73
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* Sat Apr 18 2020 Christoph Junghans <junghans@votca.org> - 1.6-1
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- Version bump to v1.6 (bug #1825475)
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- Drop 381.patch - merged upstream
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* Mon Feb 10 2020 Christoph Junghans <junghans@votca.org> - 1.6~rc2-1
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- Version bump to 1.6~rc2
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- Drop 345.patch & 347.patch - merged upstream
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- Add 381.patch to fix 32-bit build
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* Fri Jan 31 2020 Fedora Release Engineering <releng@fedoraproject.org> - 1.6-0.3rc1
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_32_Mass_Rebuild
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* Thu Dec 12 2019 Christoph Junghans <junghans@votca.org> - 1.6-0.2rc1
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- Added upstream 347.patch to fix 32bit builds
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- Added upstream 345.patch to fix failing tests
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* Thu Dec 05 2019 Christoph Junghans <junghans@votca.org> - 1.6-0.1rc1
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- Version bump to 1.6_rc1 (bug #1779897)
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* Fri Nov 22 2019 Christoph Junghans <junghans@votca.org> - 1.5.1-1
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- Version bump to 1.5.1 (bug #1774855)
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* Sat Jul 27 2019 Fedora Release Engineering <releng@fedoraproject.org> - 1.5-1.3
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_31_Mass_Rebuild
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* Tue Mar 12 2019 Orion Poplawski <orion@nwra.com> - 1.5-1.2
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- Rebuild for hdf5 1.10.5
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* Sun Feb 03 2019 Fedora Release Engineering <releng@fedoraproject.org> - 1.5-1.1
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_30_Mass_Rebuild
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* Sat Feb 02 2019 Christoph Junghans <junghans@votca.org> - 1.5-1
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- Version bump to v1.5 (bug #1667602)
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- drop 55.patch, merged upstream
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- Fix FTBFS (bug #1606654)
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* Sat Jul 14 2018 Fedora Release Engineering <releng@fedoraproject.org> - 1.4.1-1.3
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_29_Mass_Rebuild
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* Fri Feb 09 2018 Fedora Release Engineering <releng@fedoraproject.org> - 1.4.1-1.2
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_28_Mass_Rebuild
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* Wed Jan 31 2018 Christoph Junghans <junghans@votca.org> - 1.4.1-1.1
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- Rebuilt for Boost 1.66
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- Add 55.patch
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* Sun Sep 03 2017 Christoph Junghans <junghans@votca.org> - 1.4.1-1
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- Update to 1.4.1 (#1487881)
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* Thu Aug 03 2017 Fedora Release Engineering <releng@fedoraproject.org> - 1.4-2.4
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_27_Binutils_Mass_Rebuild
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* Thu Jul 27 2017 Fedora Release Engineering <releng@fedoraproject.org> - 1.4-2.3
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_27_Mass_Rebuild
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* Mon Jul 24 2017 Björn Esser <besser82@fedoraproject.org> - 1.4-2.2
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- Rebuilt for Boost 1.64
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* Mon May 15 2017 Fedora Release Engineering <rel-eng@lists.fedoraproject.org> - 1.4-2.1
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- Rebuilt for https://fedoraproject.org/wiki/Fedora_26_27_Mass_Rebuild
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* Tue Feb 07 2017 Kalev Lember <klember@redhat.com> - 1.4-2
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- Rebuilt for Boost 1.63
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* Sun Oct 30 2016 Christoph Junghans <junghans@votca.org> - 1.4-1
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- Update to 1.4
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* Mon Oct 03 2016 Christoph Junghans <junghans@votca.org> - 1.4-0.2rc1
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- Changes from review (bug #1380540)
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* Wed Sep 28 2016 Christoph Junghans <junghans@votca.org> - 1.4-0.1rc1
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- Imported 1.4_rc1
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