[ Bron: openbabel ]
Pakket: libopenbabel7 (3.1.1+dfsg-9 en anderen)
Verwijzigingen voor libopenbabel7
Debian bronnen:
Het bronpakket openbabel downloaden:
- [openbabel_3.1.1+dfsg-9.dsc]
- [openbabel_3.1.1+dfsg.orig.tar.xz]
- [openbabel_3.1.1+dfsg-9.debian.tar.xz]
Beheerders:
- Debichem Team (QA-pagina, Mailarchief)
- Michael Banck (QA-pagina)
- Daniel Leidert (QA-pagina)
- Andrius Merkys (QA-pagina)
Externe bronnen:
- Homepage [openbabel.sourceforge.net]
Vergelijkbare pakketten:
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.
Andere aan libopenbabel7 gerelateerde pakketten
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Ook een virtueel pakket geboden door: libc6-udeb
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