Ubuntu
openbabel package

openbabel 2.3.0+dfsg-2ubuntu1 source package in Ubuntu

Changelog

openbabel (2.3.0+dfsg-2ubuntu1) oneiric; urgency=low

  * Merge with Debian (fix LP: #791235); remaining changes:
    - Don't build the openbabel-gui package: Addresses: 780971.

openbabel (2.3.0+dfsg-2) UNRELEASED; urgency=low

  * debian/rules: Make override_dh_auto_test a no-op (closes: 624597).
 -- Matthias Klose <email address hidden>   Fri, 26 Aug 2011 14:50:12 +0200

Upload details

Uploaded by:
Matthias Klose
Uploaded to:
Oneiric
Original maintainer:
Debichem Team
Architectures:
any
Section:
science
Urgency:
Low Urgency

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File Size SHA-256 Checksum
openbabel_2.3.0+dfsg.orig.tar.gz 10.5 MiB 274720303e455e9c87ede362d7185fcaeaa40eb9028c7fb091e8324221fbd8fc
openbabel_2.3.0+dfsg-2ubuntu1.debian.tar.gz 11.4 KiB d40121207d12e4ba736d0ba49d3cced6da81401cb5ca59b4ecdd29153e64899e
openbabel_2.3.0+dfsg-2ubuntu1.dsc 1.6 KiB e619af6ec78c303d75bf75eb35db182179561d386f0f39f86769481d086553e2

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Binary packages built by this source

libchemistry-openbabel-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: No summary available for libopenbabel-dev in ubuntu oneiric.

No description available for libopenbabel-dev in ubuntu oneiric.

libopenbabel-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.

libopenbabel4: 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.

openbabel: No summary available for openbabel in ubuntu oneiric.

No description available for openbabel in ubuntu oneiric.

python-openbabel: Chemical toolbox library (python 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 Python binding.