libghemical-data_3.0.0-4.2_all.deb


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Description

libghemical-data - Molecular Modelling Library (data files)

Property Value
Distribution Debian 10 (Buster)
Repository Debian Main i386
Package filename libghemical-data_3.0.0-4.2_all.deb
Package name libghemical-data
Package version 3.0.0
Package release 4.2
Package architecture all
Package type deb
Category field::chemistry role::app-data science
Homepage http://bioinformatics.org/ghemical/ghemical/
License -
Maintainer Debichem Team <debichem-devel@lists.alioth.debian.org>
Download size 106.52 KB
Installed size 789.00 KB
Libghemical is the basis of Ghemical, a GNOME Molecular Modelling
Application.
This package contains the parameter files for libghemicals
semi-empirical methods.

Alternatives

Package Version Architecture Repository
libghemical-data_3.0.0-4.2_all.deb 3.0.0 all Debian Main
libghemical-data - - -

Download

Type URL
Mirror ftp.br.debian.org
Binary Package libghemical-data_3.0.0-4.2_all.deb
Source Package libghemical

Install Howto

  1. Update the package index:
    # sudo apt-get update
  2. Install libghemical-data deb package:
    # sudo apt-get install libghemical-data

Files

Path
/usr/share/doc/libghemical-data/changelog.Debian.gz
/usr/share/doc/libghemical-data/changelog.gz
/usr/share/doc/libghemical-data/copyright
/usr/share/libghemical/3.0.0/amber/all_amino94_MOD.in
/usr/share/libghemical/3.0.0/amber/all_aminoct94.in
/usr/share/libghemical/3.0.0/amber/all_aminont94.in
/usr/share/libghemical/3.0.0/amber/all_nuc94_MOD.in
/usr/share/libghemical/3.0.0/amber/parm99_frcmod_ff99SB.dat
/usr/share/libghemical/3.0.0/builder/amino.txt
/usr/share/libghemical/3.0.0/builder/nucleic.txt
/usr/share/libghemical/3.0.0/param_mm/default/atomtypes.txt
/usr/share/libghemical/3.0.0/param_mm/default/parameters1.txt
/usr/share/libghemical/3.0.0/param_mm/default/parameters2.txt
/usr/share/libghemical/3.0.0/param_mm/default/parameters3.txt
/usr/share/libghemical/3.0.0/param_mm/default/parameters4.txt
/usr/share/libghemical/3.0.0/param_mm/prmfit/atomtypes.txt
/usr/share/libghemical/3.0.0/param_mm/prmfit/parameters1.txt
/usr/share/libghemical/3.0.0/param_mm/prmfit/parameters2.txt
/usr/share/libghemical/3.0.0/param_mm/prmfit/parameters3.txt
/usr/share/libghemical/3.0.0/param_mm/prmfit/parameters4.txt
/usr/share/libghemical/3.0.0/param_mm/tripos52/atomtypes.txt
/usr/share/libghemical/3.0.0/param_mm/tripos52/parameters1.txt
/usr/share/libghemical/3.0.0/param_mm/tripos52/parameters2.txt
/usr/share/libghemical/3.0.0/param_mm/tripos52/parameters3.txt
/usr/share/libghemical/3.0.0/param_mm/tripos52/parameters4.txt
/usr/share/libghemical/3.0.0/param_mm/tripos52/parameters5.txt
/usr/share/libghemical/3.0.0/param_sf/default/loopdip.txt
/usr/share/libghemical/3.0.0/param_sf/default/looptor.txt
/usr/share/libghemical/3.0.0/param_sf/default/nonbonded.txt
/usr/share/locale/de/LC_MESSAGES/libghemical.mo
/usr/share/locale/fi/LC_MESSAGES/libghemical.mo
/usr/share/locale/mk/LC_MESSAGES/libghemical.mo
/usr/share/locale/pt_BR/LC_MESSAGES/libghemical.mo
/usr/share/locale/ru/LC_MESSAGES/libghemical.mo
/usr/share/locale/sq/LC_MESSAGES/libghemical.mo

Changelog

2018-04-18 - Alastair McKinstry <mckinstry@debian.org>
libghemical (3.0.0-4.2) unstable; urgency=medium
* Non-maintainer upload.
* Update build patch for multi-arch mpi (use pkg-config)
2015-08-16 - Julien Cristau <jcristau@debian.org>
libghemical (3.0.0-4.1) unstable; urgency=medium
* Non-maintainer upload.
* Rename library packages for g++5 ABI transition (closes: 791123).
2014-10-27 - Michael Banck <mbanck@debian.org>
libghemical (3.0.0-4) unstable; urgency=high
* debian/patches/fix-underlinking.patch: Use -lmpi++ instead of -lmpi_cxx.
Fixes FTBFS error on mpich architectures (s390x).
2014-10-26 - Michael Banck <mbanck@debian.org>
libghemical (3.0.0-3) unstable; urgency=medium
[ Daniel Leidert (dale) ]
* debian/control (Uploaders): Removed myself.
[ Michael Banck ]
* Sync with Ubuntu (Closes: #765230).
[ Graham Inggs ]
* Add fix-underlinking.patch: link MPI libraries (Closes: #722162).
* Add debian/clean: allow package to build twice in a row.
2013-12-22 - Dimitri John Ledkov <xnox@ubuntu.com>
libghemical (3.0.0-2ubuntu1) trusty; urgency=medium
* Apply autoreconf for better port coverage.
2013-12-22 - Dimitri John Ledkov <xnox@ubuntu.com>
libghemical (3.0.0-2build1) trusty; urgency=medium
* No change rebuild against libopenmpi1.6.
2011-11-28 - Daniel Leidert (dale) <daniel.leidert@wgdd.de>
libghemical (3.0.0-2) unstable; urgency=low
* debian/libghemical5.symbols: Removed again. Because there is only one
package depending on this library, the work necessary to maintain per-arch
symbols files is not worth it. This will fix the FTBFS on many
architectures.
2011-11-27 - Daniel Leidert (dale) <daniel.leidert@wgdd.de>
libghemical (3.0.0-1) unstable; urgency=low
* New upstream release.
* debian/control (Build-Depends): Dropped dpatch. Added autotools version.
(Vcs-Browser): Point to the real location.
* debian/libghemical5.symbols: Added symbols.
* debian/rules: Dropped dpatch stuff.
* debian/README.source: Dropped obsolete file.
* debian/source/format: Added for source format 3.0 (quilt).
* debian/patches/04_german_translation.dpatch: Dropped (applied upstream).
* debian/patches/00list: Renamed to debian/patches/series and adjusted.
2011-09-05 - Michael Banck <mbanck@debian.org>
libghemical (2.99.1-2) unstable; urgency=low
[ Daniel Leidert (dale) ]
* debian/compat: Bumped to dh compat level 7.
* debian/control (Build-Depends): Bumped dh version and dropped cdbs.
(Standards-Version): Bumped to 3.8.4.
* debian/rules: Dh 7 rewrite. Dropped cdbs.
* debian/README.source: Dropped cdbs hint.
[ Michael Banck ]
* debian/patches/04_german_translation.dpatch: Added (closes: #637012).
- po/de.po: Adds german translation by Chris Leick <c.leick@vollbio.de>.
- po/LINGUAS: Adjusted.
* debian/patches/00list: Adjusted.
* debian/control (Standards-Version): Bumped to 3.9.2. 
2009-09-22 - Daniel Leidert (dale) <daniel.leidert@wgdd.de>
libghemical (2.99.1-1) unstable; urgency=low
* New upstream release.
* debian/control: Transition from libghemical4 to libghemical5.
(Standards-Version): Bumped to 3.8.3.
(Build-Depends): Added intltool.
(Vcs-Svn): Fixed vcs-field-uses-not-recommended-uri-format.
* debian/libghemical4.install: Renamed to debian/libghemical5.install.
* debian/libghemical-data.install: Added locale files.
* debian/rules: Added rule to list missing files. Replaces --list-missing
in DEB_DH_INSTALL_ARGS.
* debian/patches/01_gcc43.dpatch: Dropped (applied upstream).
* debian/patches/configure_libmopac_flags.dpatch: Ditto.
* debian/patches/00list: Adjusted.

See Also

Package Description
libghemical-dev_3.0.0-4.2_i386.deb Molecular Modelling Library (development files)
libghemical5v5_3.0.0-4.2_i386.deb Molecular Modelling Library
libghmm-dev_0.9~rc3-2_i386.deb General Hidden-Markov-Model library - header files
libghmm1_0.9~rc3-2_i386.deb General Hidden-Markov-Model library
libgiac-dev_1.4.9.69+dfsg1-2_i386.deb Computer Algebra System C++ library - Development files
libgiac0_1.4.9.69+dfsg1-2_i386.deb Computer Algebra System C++ library
libgif-dev_5.1.4-3_i386.deb library for GIF images (development)
libgif7_5.1.4-3_i386.deb library for GIF images (library)
libgiftiio-dev_1.0.9-3_i386.deb IO library for the GIFTI cortical surface data format
libgiftiio0_1.0.9-3_i386.deb IO library for the GIFTI cortical surface data format
libgig-dev_4.1.0~repack-2_i386.deb development files for libgig
libgig-doc_4.1.0~repack-2_all.deb HTML documentation for libgig
libgig8_4.1.0~repack-2_i386.deb library for loading and modifying Gigasampler and DLS files
libgimp2.0-dev_2.10.8-2_i386.deb Headers and other files for compiling plugins for GIMP
libgimp2.0-doc_2.10.8-2_all.deb Developers' Documentation for the GIMP library
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