Accepted chemps2 1.8.9-1 (source) into unstable

2018-11-16 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Fri, 16 Nov 2018 11:29:15 +
Source: chemps2
Binary: libchemps2-3 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source
Version: 1.8.9-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team 
Changed-By: Sebastian Wouters 
Description:
 chemps2- Executable to call libchemps2-3 from the command line
 chemps2-doc - Documentation of the libchemps2-3 package
 libchemps2-3 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3
 python3-chemps2 - Python 3 interface for libchemps2-3
Changes:
 chemps2 (1.8.9-1) unstable; urgency=medium
 .
   * Upstream 1.8.9: Bug fix long double literals in Wigner.cpp
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Accepted chemps2 1.8.8-1 (source) into unstable

2018-10-05 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Fri, 05 Oct 2018 13:50:59 +
Source: chemps2
Binary: libchemps2-3 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source
Version: 1.8.8-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team 
Changed-By: Sebastian Wouters 
Description:
 chemps2- Executable to call libchemps2-3 from the command line
 chemps2-doc - Documentation of the libchemps2-3 package
 libchemps2-3 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3
 python3-chemps2 - Python 3 interface for libchemps2-3
Changes:
 chemps2 (1.8.8-1) unstable; urgency=medium
 .
   * Upstream 1.8.8: Print number of MPS variables
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Accepted chemps2 1.8.7-3 (source) into unstable

2018-05-19 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Sat, 19 May 2018 16:01:06 +0200
Source: chemps2
Binary: libchemps2-3 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source
Version: 1.8.7-3
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-3 from the command line
 chemps2-doc - Documentation of the libchemps2-3 package
 libchemps2-3 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3
 python3-chemps2 - Python 3 interface for libchemps2-3
Changes:
 chemps2 (1.8.7-3) unstable; urgency=medium
 .
   * autopkgtest: renamed upstream to libtest,
 added pytest and bintest
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Accepted chemps2 1.8.7-2 (source) into unstable

2018-05-05 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Sat, 05 May 2018 19:21:27 +0200
Source: chemps2
Binary: libchemps2-3 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source
Version: 1.8.7-2
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-3 from the command line
 chemps2-doc - Documentation of the libchemps2-3 package
 libchemps2-3 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3
 python3-chemps2 - Python 3 interface for libchemps2-3
Closes: 897329
Changes:
 chemps2 (1.8.7-2) unstable; urgency=medium
 .
   * libchemps2-dev Multi-Arch: no (Closes: #897329)
   * rules: export DEB_BUILD_MAINT_OPTIONS=hardening=+all
   * Bump debhelper to 11
   * Bump Standards-Version to 4.1.4
   * Added autopkgtest (upstream test1)
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Accepted chemps2 1.8.7-1 (source amd64 all) into unstable, unstable

2018-03-27 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Sun, 25 Mar 2018 22:09:14 +0200
Source: chemps2
Binary: libchemps2-3 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source amd64 all
Version: 1.8.7-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-3 from the command line
 chemps2-doc - Documentation of the libchemps2-3 package
 libchemps2-3 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-3
 python3-chemps2 - Python 3 interface for libchemps2-3
Changes:
 chemps2 (1.8.7-1) unstable; urgency=medium
 .
   * Upstream 1.8.6: Set initial guess to ROHF determinant
   * Added optional arguments to DMRG::DMRG and
 DMRG::setupBookkeeperAndMPS
   * Upstream 1.8.7: Bump up SO version
   * libchemps2-2 becomes libchemps2-3
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Accepted chemps2 1.8.5-1 (source amd64 all) into unstable, unstable

2018-02-04 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA256

Format: 1.8
Date: Mon, 15 Jan 2018 22:42:13 +0100
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python3-chemps2
Architecture: source amd64 all
Version: 1.8.5-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python3-chemps2 - Python 3 interface for libchemps2-2
Closes: 887104
Changes:
 chemps2 (1.8.5-1) unstable; urgency=medium
 .
   * Changes upstream 1.8.5
   * Install cmake config files with libchemps2-dev (Closes: #887104)
   * Install cmake target files with libchemps2-dev
   * Bump Standards-Version to 4.1.3
   * Deprecate python-chemps2 package
   * Introduce python3-chemps2 package
   * Update rules: python3, dh_numpy3
   * Build-Depends remove python-all, python-setuptools,
 python-docutils, python-sphinx, cython,
 python-numpy and libpython-dev
   * Build-Depends add python3-all (>= 3.6), python3-setuptools,
 python3-docutils, python3-sphinx, cython3,
 python3-numpy and libpython3-dev
   * Update copyright
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Accepted chemps2 1.8.4-2 (source) into unstable

2017-07-16 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Sun, 16 Jul 2017 15:21:57 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8.4-2
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.8.4-2) unstable; urgency=medium
 .
   * Upload to unstable now that Stretch is released
   * Bump debhelper to 10
   * Bump Standards-Version to 4.0.0
   * In copyright-format https is preferred
   * Cmake 3.0.2 required by upstream 1.8.4
   * Overwrite CMAKE_VERBOSE_MAKEFILE=OFF in upstream
 by passing VERBOSE=1 to make in debian/rules
   * Multi-Arch: foreign for chemps2-doc
   * Multi-Arch: same for libchemps2-2, libchemps2-dev,
 and python-chemps2
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Accepted chemps2 1.8.4-1 (source) into experimental

2017-05-23 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Tue, 23 May 2017 22:19:44 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8.4-1
Distribution: experimental
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.8.4-1) experimental; urgency=medium
 .
   * Upstream release v1.8.4 (MOLCAS interface + build system)
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Accepted chemps2 1.8.3-2 (source) into unstable

2016-12-08 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Thu, 08 Dec 2016 12:44:07 +0100
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8.3-2
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.8.3-2) unstable; urgency=medium
 .
   * Fix lintian errors (i386 build)
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Accepted chemps2 1.8.3-1 (source) into unstable

2016-11-17 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Tue, 15 Nov 2016 20:07:44 +0100
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8.3-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.8.3-1) unstable; urgency=medium
 .
   * Upstream release v1.8.3 (MOLCAS interface)
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Accepted chemps2 1.8.2-1 (source) into unstable

2016-10-28 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Wed, 26 Oct 2016 22:20:02 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8.2-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Closes: 841954
Changes:
 chemps2 (1.8.2-1) unstable; urgency=medium
 .
   [ Sebastian Wouters ]
   * Upstream release v1.8.2 (fixing build)
   * Upstream release v1.8.1 (MOLCAS interface)
 .
   [ Gilles Filippini ]
   * Update symbols file to support HDF5 1.10 (Closes: #841954)
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Accepted chemps2 1.8-2 (source) into unstable

2016-09-09 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Thu, 08 Sep 2016 21:58:29 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8-2
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Closes: 808312
Changes:
 chemps2 (1.8-2) unstable; urgency=medium
 .
* Fix overwriting chemps2.1.gz libchemps2-1 (Closes: #808312)
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Accepted chemps2 1.8-1 (source) into unstable

2016-08-24 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Wed, 24 Aug 2016 10:30:29 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.8-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.8-1) unstable; urgency=medium
 .
* LTS release upstream
* Bug fix linear Davidson algo (CASPT2)
* Bug fix MPI in executable.cpp
* MOLCAS interface
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Accepted chemps2 1.7.3-1 (source) into unstable

2016-07-26 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Tue, 26 Jul 2016 11:41:29 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.7.3-1
Distribution: unstable
Urgency: low
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.7.3-1) unstable; urgency=low
 .
* Upstream release v1.7.1 for psi4
* Upstream release v1.7.2 for DMRG workshop
* Upstream release v1.7.3 with new documentation
* Linear Davidson solver for CASPT2
* Global Fiedler reordering allowed
* Use libblas-dev and liblapack-dev i.o. libatlas-base-dev
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Accepted chemps2 1.7-1 (source amd64 all) into unstable, unstable

2016-05-26 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Wed, 25 May 2016 10:03:11 +0200
Source: chemps2
Binary: libchemps2-2 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source amd64 all
Version: 1.7-1
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-2 from the command line
 chemps2-doc - Documentation of the libchemps2-2 package
 libchemps2-2 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-2
 python-chemps2 - Python 2 interface for libchemps2-2
Changes:
 chemps2 (1.7-1) unstable; urgency=medium
 .
* Upstream release v1.7
* Bump SO version to libchemps2.so.2
* Package no longer depends on GSL
* Update symbols file
* New package description for added features
* Bump Standards-Version to 3.9.8
* Fix unsafe Vcs-* URI
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Accepted chemps2 1.6-3 (source) into unstable

2015-12-27 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Wed, 23 Dec 2015 21:31:16 +0100
Source: chemps2
Binary: libchemps2-1 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source
Version: 1.6-3
Distribution: unstable
Urgency: medium
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-1 from the command line
 chemps2-doc - Documentation of the libchemps2-1 package
 libchemps2-1 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-1
 python-chemps2 - Python 2 interface for libchemps2-1
Closes: 808312
Changes:
 chemps2 (1.6-3) unstable; urgency=medium
 .
   * Fix overwriting chemps2.1.gz (manpage moved from libchemps2-1
 to chemps2) (Closes: #808312)
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Accepted chemps2 1.6-1 (source all amd64) into unstable, unstable

2015-09-04 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA512

Format: 1.8
Date: Fri, 28 Aug 2015 10:10:14 -0400
Source: chemps2
Binary: libchemps2-1 libchemps2-dev chemps2-doc chemps2 python-chemps2
Architecture: source all amd64
Version: 1.6-1
Distribution: unstable
Urgency: low
Maintainer: Debichem Team <debichem-de...@lists.alioth.debian.org>
Changed-By: Sebastian Wouters <sebastianwout...@gmail.com>
Description:
 chemps2- Executable to call libchemps2-1 from the command line
 chemps2-doc - Documentation of the libchemps2-1 package
 libchemps2-1 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-1
 python-chemps2 - Python 2 interface for libchemps2-1
Closes: 795789
Changes:
 chemps2 (1.6-1) unstable; urgency=low
 .
   * Upstream release v1.6
   * debian/control: Standards-Version 3.9.6
   * Package: chemps2 (executable)
   * Fix lintian warnings jquery.js and underscore.js
   * Fix watch file (Closes: #795789)
   * Update libchemps2-1.symbols for cxx11 (new symbols v1.6)
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libchemps2-1_1.6-1_amd64.deb
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libchemps2-dev_1.6-1_amd64.deb
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python-chemps2_1.6-1_amd64.deb

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Accepted chemps2 1.5-2 (source) into unstable

2015-08-22 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA1

Format: 1.8
Date: Sat, 22 Aug 2015 19:53:36 +0200
Source: chemps2
Binary: libchemps2-1 libchemps2-dev chemps2-doc python-chemps2
Architecture: source
Version: 1.5-2
Distribution: unstable
Urgency: low
Maintainer: Debichem Team debichem-de...@lists.alioth.debian.org
Changed-By: Sebastian Wouters sebastianwout...@gmail.com
Description:
 chemps2-doc - Documentation of the libchemps2-1 package
 libchemps2-1 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-1
 python-chemps2 - Python 2 interface for libchemps2-1
Closes: 792047 792051 795138 796065
Changes:
 chemps2 (1.5-2) unstable; urgency=low
 .
   [ Sebastian Wouters ]
   * Fix difference DEB_HOST_GNU_TYPE and DEB_HOST_MULTIARCH
 on i386 (Closes: #792047)
   * Fix library dependency BLAS for kFreeBSD (Closes: #792051)
   * Fix date issues changelog (Closes: #795138)
   * Fix build-depends python-support (Closes: #796065)
 .
   [ Graham Inggs ]
   * Update libchemps2-1.symbols for cxx11
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Accepted chemps2 1.5-1 (source all amd64) into unstable, unstable

2015-07-10 Thread Sebastian Wouters 
-BEGIN PGP SIGNED MESSAGE-
Hash: SHA1

Format: 1.8
Date: Sun, 14 June 2015 13:17:33 -0400
Source: chemps2
Binary: libchemps2-1 libchemps2-dev chemps2-doc python-chemps2
Architecture: source all amd64
Version: 1.5-1
Distribution: unstable
Urgency: low
Maintainer: Debichem Team debichem-de...@lists.alioth.debian.org
Changed-By: Sebastian Wouters sebastianwout...@gmail.com
Description:
 chemps2-doc - Documentation of the libchemps2-1 package
 libchemps2-1 - Spin-adapted DMRG for ab initio quantum chemistry
 libchemps2-dev - C++ headers, static library, and symlink for libchemps2-1
 python-chemps2 - Python 2 interface for libchemps2-1
Closes: 771112
Changes:
 chemps2 (1.5-1) unstable; urgency=low
 .
   * Initial release (Closes: #771112)
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