libchemistry-openbabel-perl binary package in Ubuntu Precise armhf
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:
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* 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
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File formats Open Babel supports include PDB, XYZ, CIF, CML, SMILES, MDL
Molfile, ChemDraw, Gaussian, GAMESS, MOPAC and MPQC.
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This package contains the Perl binding.
Publishing history
Date | Status | Target | Component | Section | Priority | Phased updates | Version | ||
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2011-12-18 02:33:36 UTC | Published | Ubuntu Precise armhf | release | universe | perl | Optional | 2.3.0+dfsg-3ubuntu3 | ||
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2011-12-18 02:34:23 UTC | Superseded | Ubuntu Precise armhf | release | universe | perl | Optional | 2.3.0+dfsg-3ubuntu2 | ||
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