| Key | Value |
|---|---|
| FileSize | 638016 |
| MD5 | BBCB5569D6B1C52DCF13458A0265FDFF |
| PackageDescription | 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. |
| PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
| PackageName | libchemistry-openbabel-perl |
| PackageSection | perl |
| PackageVersion | 3.1.1+dfsg-6 |
| SHA-1 | 313A9017FB401B1FD6E84234D8245B9C76CF85E2 |
| SHA-256 | 82398C1C8198879E05316A78D310781D39C7211A4ED2D9A3E4542102B805F372 |
| hashlookup:children-total | 4 |
| hashlookup:trust | 50 |
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| Key | Value |
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| Key | Value |
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| Key | Value |
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