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[ Source: openbabel  ]

Package: libchemistry-openbabel-perl (3.1.1+dfsg-11 and others)

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Chemical toolbox library (perl bindings)

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 Chemistry::Openbabel, the Perl binding for Open Babel.

Tags: Software Development: Perl Development, Libraries, Implemented in: implemented-in::c, implemented-in::perl, Role: Development Library

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Download libchemistry-openbabel-perl

Download for all available architectures
Architecture Version Package Size Installed Size Files
alpha (unofficial port) 3.1.1+dfsg-9+b4 571.7 kB5,061.0 kB [list of files]
amd64 3.1.1+dfsg-11+b1 658.2 kB4,030.0 kB [list of files]
arm64 3.1.1+dfsg-11+b1 562.5 kB4,164.0 kB [list of files]
armel 3.1.1+dfsg-11+b1 598.9 kB3,828.0 kB [list of files]
armhf 3.1.1+dfsg-11+b1 626.9 kB3,080.0 kB [list of files]
hppa (unofficial port) 3.1.1+dfsg-11+b1 470.2 kB7,272.0 kB [list of files]
i386 3.1.1+dfsg-11+b1 615.5 kB4,312.0 kB [list of files]
ia64 (unofficial port) 3.1.1+dfsg-9 595.9 kB7,640.0 kB [list of files]
m68k (unofficial port) 3.1.1+dfsg-9+b1 635.6 kB4,177.0 kB [list of files]
mips64el 3.1.1+dfsg-11+b1 363.3 kB4,685.0 kB [list of files]
ppc64 (unofficial port) 3.1.1+dfsg-11+b1 544.0 kB4,834.0 kB [list of files]
ppc64el 3.1.1+dfsg-11+b1 572.1 kB4,548.0 kB [list of files]
riscv64 3.1.1+dfsg-11+b1 663.3 kB3,623.0 kB [list of files]
s390x 3.1.1+dfsg-11+b1 611.9 kB4,199.0 kB [list of files]
sh4 (unofficial port) 3.1.1+dfsg-11 633.0 kB4,015.0 kB [list of files]
sparc64 (unofficial port) 3.1.1+dfsg-11+b1 493.9 kB4,467.0 kB [list of files]
x32 (unofficial port) 3.1.1+dfsg-9+b1 657.7 kB3,925.0 kB [list of files]