all options
buster  ] [  bullseye  ] [  bookworm  ] [  trixie  ] [  sid  ]
[ Source:  ]

Package: libchemistry-openbabel-perl (3.1.1+dfsg-9 and others) [debports]

Links for libchemistry-openbabel-perl

Screenshot

Debian Resources:

Download Source Package :

Not found

Maintainers:

External Resources:

Similar packages:

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.

Other Packages Related to libchemistry-openbabel-perl

  • depends
  • recommends
  • suggests
  • enhances

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]