Package: libopenbabel7 (3.1.1+dfsg-11 and others)

[ Source: openbabel  ]

Chemical toolbox library

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 shared library.

Tags: Role: Shared Library

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• dep: libgcc-s1 (>= 3.0)

  GCC támogató programkönyvtár

• dep: libgomp1 (>= 4.9)

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• dep: libinchi1.07 (>= 1.07.1+dfsg)

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• dep: libmaeparser1 (>= 1.3.1)

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• dep: libstdc++6 (>= 13.1)

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• dep: libxml2 (>= 2.7.4)

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Download libopenbabel7

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Architecture	Version	Package Size	Installed Size	Files
ppc64el	3.1.1+dfsg-11+b1	3,256.9 kB	20,029.0 kB	[list of files]