[Debichem-devel] openbabel_2.3.0+dfsg-1_i386.changes is NEW
Debian FTP Masters
ftpmaster at ftp-master.debian.org
Fri Apr 22 11:32:35 UTC 2011
(new) libchemistry-openbabel-perl_2.3.0+dfsg-1_i386.deb optional perl
Chemical toolbox library (perl bindings)
Open Babel is a chemical toolbox designed to speak the many languages of
chemical data. It allows to search, convert, analyze, or store data from
molecular modeling, chemistry, solid-state materials, biochemistry, or related
areas. Features include:
.
* Hydrogen addition and deletion
* Support for Molecular Mechanics
* Support for SMARTS molecular matching syntax
* Automatic feature perception (rings, bonds, hybridization, aromaticity)
* Flexible atom typer and perception of multiple bonds from atomic coordinates
* Gasteiger-Marsili partial charge calculation
.
File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL
Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.
.
This package contains the Perl binding.
libopenbabel-dev_2.3.0+dfsg-1_i386.deb
to main/o/openbabel/libopenbabel-dev_2.3.0+dfsg-1_i386.deb
(new) libopenbabel-doc_2.3.0+dfsg-1_all.deb optional doc
Chemical toolbox library (documentation)
Open Babel is a chemical toolbox designed to speak the many languages of
chemical data. It allows to search, convert, analyze, or store data from
molecular modeling, chemistry, solid-state materials, biochemistry, or related
areas. Features include:
.
* Hydrogen addition and deletion
* Support for Molecular Mechanics
* Support for SMARTS molecular matching syntax
* Automatic feature perception (rings, bonds, hybridization, aromaticity)
* Flexible atom typer and perception of multiple bonds from atomic coordinates
* Gasteiger-Marsili partial charge calculation
.
File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL
Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.
.
This package contains the library documentation.
(new) libopenbabel4_2.3.0+dfsg-1_i386.deb optional libs
Chemical toolbox library
Open Babel is a chemical toolbox designed to speak the many languages of
chemical data. It allows to search, convert, analyze, or store data from
molecular modeling, chemistry, solid-state materials, biochemistry, or related
areas. Features include:
.
* Hydrogen addition and deletion
* Support for Molecular Mechanics
* Support for SMARTS molecular matching syntax
* Automatic feature perception (rings, bonds, hybridization, aromaticity)
* Flexible atom typer and perception of multiple bonds from atomic coordinates
* Gasteiger-Marsili partial charge calculation
.
File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL
Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.
.
This package contains the shared library.
(new) openbabel-gui_2.3.0+dfsg-1_i386.deb optional science
Chemical toolbox utilities (graphical user interface)
Open Babel is a chemical toolbox designed to speak the many languages of
chemical data. It allows to search, convert, analyze, or store data from
molecular modeling, chemistry, solid-state materials, biochemistry, or related
areas. Features include:
.
* Hydrogen addition and deletion
* Support for Molecular Mechanics
* Support for SMARTS molecular matching syntax
* Automatic feature perception (rings, bonds, hybridization, aromaticity)
* Flexible atom typer and perception of multiple bonds from atomic coordinates
* Gasteiger-Marsili partial charge calculation
.
File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL
Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.
.
This package contains the openbabel GUI based on wxWidgets.
openbabel_2.3.0+dfsg-1.debian.tar.gz
to main/o/openbabel/openbabel_2.3.0+dfsg-1.debian.tar.gz
openbabel_2.3.0+dfsg-1.dsc
to main/o/openbabel/openbabel_2.3.0+dfsg-1.dsc
openbabel_2.3.0+dfsg-1_i386.deb
to main/o/openbabel/openbabel_2.3.0+dfsg-1_i386.deb
openbabel_2.3.0+dfsg.orig.tar.gz
to main/o/openbabel/openbabel_2.3.0+dfsg.orig.tar.gz
python-openbabel_2.3.0+dfsg-1_i386.deb
to main/o/openbabel/python-openbabel_2.3.0+dfsg-1_i386.deb
Changes: openbabel (2.3.0+dfsg-1) unstable; urgency=low
.
[ Michael Banck ]
* New upstream release.
* debian/compat: Bumped to 7.
* debian/control (libopenbabel3): Renamed package to libopenbabel4.
(Build-Depends): Added cmake and libeigen2-dev. Removed libboost-dev. Bump
debhelper Build-Depends to 7 and remove cdbs.
* debian/libopenbabel3.install: Renamed to ...
* debian/libopenbabel4.install: ... this.
* debian/libopenbabel4.install: Renamed formats plugin directory for major
upstream version change.
* debian/libopenbabel-dev.install: Removed currently unbuilt static library.
* debian/openbabel.install: Adjusted for renamed Povray include file.
* debian/rules: Rewrote using dh7.
* debian/source/format: New file, specifying source format "3.0 (quilt)".
* debian/patches/libinchi_static.patch: New patch, force a static build of
the inchi library.
* debian/patches/fix_parallel_build.patch: New patch, fixes parallel
building, taken from upstream subversion revision 4285 and 4376. Further
patch to allow to pass INSTALLDIRS=vendor for Perl binding target (4377).
* debian/patches/series: Adjusted.
* debian/rules (CMAKE_OPTIONS): New variable.
* debian/control: Renamed libopenbabel-perl to libchemistry-openbabel-perl.
* debian/get-orig-source.sh: Updated for new .dll in scripts/csharp.
.
[ Daniel Leidert ]
* debian/control: Added packages libopenbabel-doc, openbabel-gui and
libopenbabel-perl (LP: #125115).
(Standards-Version): Bumped to 3.9.1.
(Build-Depends): Added libperl-dev and libwxgtk2.8-dev for Perl bindings
and graphical user interface.
(Vcs-Browser): Point to the source location.
* debian/get-orig-source.sh: Script added for source repackaging.
* debian/libopenbabel4.install,
debian/libopenbabel-dev.install,
debian/openbabel.install,
debian/openbabel-gui.install: Minor rewrite because we only copy files.
* debian/libopenbabel-doc.docs,
debian/libopenbabel-perl.install,
debian/openbabel-gui.install: Added for new packages.
* debian/rules: Enable parallel builds. Build Perl bindings and the GUI.
Include python.mk for $(py_setup_install_args).
* debian/watch: Added rules to handle +dfsg suffix. Run get-orig-source.sh
script to repackage source.
* debian/README.source: Update. Document re-packaging the source.
* debian/patches/obabel_manpage_additions.patch: Added.
- Create manual pages for obabel and OBGUI.
* debian/patches/series: Adjusted.
Override entries for your package:
libopenbabel-dev_2.3.0+dfsg-1_i386.deb - optional libdevel
openbabel_2.3.0+dfsg-1.dsc - source science
openbabel_2.3.0+dfsg-1_i386.deb - optional science
python-openbabel_2.3.0+dfsg-1_i386.deb - optional python
Announcing to debian-devel-changes at lists.debian.org
Your package contains new components which requires manual editing of
the override file. It is ok otherwise, so please be patient. New
packages are usually added to the override file about once a week.
You may have gotten the distribution wrong. You'll get warnings above
if files already exist in other distributions.
More information about the Debichem-devel
mailing list