| Key | Value |
|---|---|
| FileSize | 3048560 |
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| PackageDescription | Chemical toolbox library Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It allows 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. |
| PackageMaintainer | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
| PackageName | libopenbabel4 |
| PackageSection | libs |
| PackageVersion | 2.3.0+dfsg-3ubuntu3 |
| SHA-1 | 93BFF58815C0D8FEE1CA77AF2325005B4CCE596E |
| SHA-256 | A103FE4311BAD3A5B2478C3E8EDF0D2111D14344448E00068D6D1010033CA4FA |
| hashlookup:children-total | 146 |
| hashlookup:trust | 50 |
The searched file hash includes 146 children files known and seen by metalookup. A sample is included below:
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/libopenbabel4/changelog.Debian.gz |
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| Key | Value |
|---|---|
| FileName | ./usr/lib/openbabel/2.3.0/mdlformat.so |
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| Key | Value |
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| Key | Value |
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| Key | Value |
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| Key | Value |
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