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[ Source: openbabel  ]

Package: libopenbabel-dev (2.3.1+dfsg-4)

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Chemical toolbox library (development files)

Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It allows one 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 static library and the header files.

Tags: Software Development: C++ Development, Libraries, Field: Chemistry, Implemented in: implemented-in::c++, role::devel-lib, Purpose: Data Conversion

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Architecture Package Size Installed Size Files
amd64 338.2 kB965.0 kB [list of files]
armel 339.4 kB965.0 kB [list of files]
armhf 338.7 kB965.0 kB [list of files]
i386 337.3 kB965.0 kB [list of files]
ia64 337.1 kB915.0 kB [list of files]
kfreebsd-amd64 336.8 kB921.0 kB [list of files]
kfreebsd-i386 336.9 kB921.0 kB [list of files]
mips 340.1 kB965.0 kB [list of files]
mipsel 337.6 kB965.0 kB [list of files]
powerpc 337.0 kB965.0 kB [list of files]
s390 338.4 kB965.0 kB [list of files]
s390x 337.4 kB965.0 kB [list of files]
sparc 338.3 kB965.0 kB [list of files]