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FileSize | 372 |
MD5 | BC1A1D748FF442A17594F275763685A7 |
SHA-1 | 01D2C6510C80AF7BCAF13F61AA1F8052888B9623 |
SHA-256 | 066ED4F7511B92D922EC33286F127F2F25D86B4E47666C81534B52E974A1CB59 |
SSDEEP | 6:KKx+ssD+z3p3aFhKlDBeG6VdfC69j/oV5DzxicdfvA5Td6sTs6Pf+kv:KKPsD+zZ3aFsRG3K6QxT2dd6sTsE+kv |
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hashlookup:parent-total | 3 |
hashlookup:trust | 65 |
The searched file hash is included in 3 parent files which include package known and seen by metalookup. A sample is included below:
Key | Value |
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FileSize | 5129200 |
MD5 | 24F1859DF3DA540DA49FBBCD1BB6D518 |
PackageDescription | Chemical toolbox library (documentation) 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 library documentation. |
PackageMaintainer | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | libopenbabel-doc |
PackageSection | doc |
PackageVersion | 3.1.1+dfsg-6ubuntu1 |
SHA-1 | D2CD8ABEB14C908DB834921DA38E231F7FBBC70B |
SHA-256 | B09E45B6C8729A38FE612105DF3170CDAB0AAC6A66A76B2ABBA695B1E580E7C8 |
Key | Value |
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FileSize | 5128108 |
MD5 | 1D25FC06D6D0C06BD8E33CA1042C0481 |
PackageDescription | Chemical toolbox library (documentation) 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 library documentation. |
PackageMaintainer | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | libopenbabel-doc |
PackageSection | doc |
PackageVersion | 3.1.1+dfsg-5ubuntu1 |
SHA-1 | F69FBA2ADE5D04033C48D075A63BA274B1EEAC33 |
SHA-256 | F858AB8F649D82C111BF8815ACD7D6A72EE39B1C3924ABAABF7AD4D76556B0DF |
Key | Value |
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FileSize | 5137464 |
MD5 | B12334A0C3693495F32BB10C77B0AE87 |
PackageDescription | Chemical toolbox library (documentation) 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 library documentation. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | libopenbabel-doc |
PackageSection | doc |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | A183B5491CABAF38AC793584971BA0B37CA52614 |
SHA-256 | 532BD5196F1EACD371FB143E37D6BA2A35F7CC24828A667B6DAB3874E07F20CC |