| Key | Value |
|---|---|
| FileSize | 388000 |
| MD5 | A4A45737B9E8771D1E48FEB4E42C5464 |
| 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 | 2010C0A8F807730ADDCB20ADCE94629C30E6504F |
| SHA-256 | 977AE6DEB16444ACA25C3779B398FBE8A02DFBD8CFBA073A689524FA6713BBDE |
| 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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