Key | Value |
---|---|
FileName | ./usr/share/doc/python-openbabel/Examples.html |
FileSize | 3156 |
MD5 | 92F74EEC44D81D49338B2DF1657C3C17 |
SHA-1 | 6C43083C59A2B2FCA5E5A593A732A6086D6F6ED6 |
SHA-256 | 6D140C757F34CDDE0D6F82ECA6DFBAE1DDDC3A6D77C9E68903A1BC8FF7912601 |
SSDEEP | 48:Qm3G4/uZFMjKStWDJ8DpnJ8gU3XacQWrQEkgW0xa4lXBDv7FCeHJ6gg/l00oTyvY:ZG427DStK8Dd23XMWj71XBT7UmDs0zWA |
TLSH | T1B0518722F9D8F23F81419F65E5DED0A04756CF8862F83948696E40C5960220F69F47E7 |
hashlookup:parent-total | 10 |
hashlookup:trust | 100 |
The searched file hash is included in 10 parent files which include package known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileSize | 615824 |
MD5 | D4179624B112BDEAADDA26CE2F7B9894 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 7D78642091C55F13DD5881BC6DAC18CEE19369A0 |
SHA-256 | F2B0BB02287D17A21A22234A545B0A8320FE54CF5BD6D5D433F5B4C34F3958F9 |
Key | Value |
---|---|
FileSize | 606772 |
MD5 | FB9C0FE61DCAEAFF7B799D2854D3316D |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | E6F466025A5B9E98F7D643B670FEE09272116A76 |
SHA-256 | 885BF7066E06AD636845236B2213DDE4CCABC167B3045734FFABF345B903240D |
Key | Value |
---|---|
FileSize | 508156 |
MD5 | D0F4DFA96BE5EABED48ACC9330772847 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | F6FAA030DF6E74404A0BD8E5333D4D6D63BC08ED |
SHA-256 | A5419A6D4532AD8687A886B55C5653CCD7C31171D5E40A2FB003FA5B05C7973F |
Key | Value |
---|---|
FileSize | 655164 |
MD5 | 584B3FE064FEA904B1DB8D00F7AFE93E |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 14D6E0DEFC8D0783A4B8F70A8E72C0143F20E4B4 |
SHA-256 | 47F51E6C498F5194077D498EE82980FDEC3F3382677C43E0FBD45469F5777C4A |
Key | Value |
---|---|
FileSize | 505068 |
MD5 | EB21A364E427858237481694AAF95080 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 3517B06B295C373CBFF575AD75B14BFDAFBD8158 |
SHA-256 | 5AD28A81DB571B955F5BBF66C6B1A6AC19A806F99D9ECFBEDAEC103CF51937B5 |
Key | Value |
---|---|
FileSize | 560260 |
MD5 | DCE2A4CCEE34AE45BBCA3483E71A8254 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 23A426DC2F6503D591B6DADB620F859BC239464B |
SHA-256 | 75E8DB6135B70089862886CAF71D1BDC4B6E9A2A3646D41270F905448BBE36AD |
Key | Value |
---|---|
FileSize | 662700 |
MD5 | 54CC4554365BE981EDE98CD596F7734E |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | ED964D9E1F263981EFD79A83E1CE72E7BD0ADC79 |
SHA-256 | C455CB7514087E5A3493AE568C3B0968B4E60EE56BCB3C1C6E9D074AA2A0D758 |
Key | Value |
---|---|
FileSize | 491568 |
MD5 | F70F338C3E4AA5F1B9F3D47E959E25C0 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 09DF7F9B9EA89C6C967E09AA7C59D028EA77B7A0 |
SHA-256 | 73B48EBA479D2059EE2C0E2D6336137FD290BF2746191436DCE12D1EC8E780CF |
Key | Value |
---|---|
FileSize | 570976 |
MD5 | 5EA1CE068FD64D40A207FCE0D0776866 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 6721419D2E19FC6478D8CC14033752D1C65A621F |
SHA-256 | 76B608515920F382A5814ADA802363D9F51440668567D1C6AB7B2D264A4A96CF |
Key | Value |
---|---|
FileSize | 661856 |
MD5 | F85C2D156A691D165BEA3091B3A2D490 |
PackageDescription | Chemical toolbox library (python 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 the Python binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | python-openbabel |
PackageSection | python |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | 1789305A61A10794D426977096BE8D19BE7EDA18 |
SHA-256 | 07D8A83DA2BE865E215C5493B91462819D6511DD43E55E2846797A8DFD3C1DE8 |