Key | Value |
---|---|
FileName | ./usr/share/doc/python3-openbabel/Examples.html |
FileSize | 3249 |
MD5 | AB6E9B5DEA4B92BB435502A6C30D3FFF |
SHA-1 | 5B4E52CDD4B40F553E1DAAC50327CD55B082FE80 |
SHA-256 | ACAF6AF884B0A1ADC445EB1E194322112519073E7870AEF434CE4534E3FAC1CF |
SSDEEP | 48:Qm3G4/uZFMjKStWDJ8DpnJ8gU3XacQWrQEkgW0xs4lXBDv7FCeH46gg/l00HTyvY:ZG427DStK8Dd23XMWj7fXBT7URDs0mWA |
TLSH | T132616622F9D4F23FC1419B96E5DAC0610B57CF8862F439485A6D40C5960221F7DB57E7 |
hashlookup:parent-total | 12 |
hashlookup:trust | 100 |
The searched file hash is included in 12 parent files which include package known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileSize | 496988 |
MD5 | 248C68A48780715D4BC52102A141A104 |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 1766BB932DFB5126E60FD7D61191E8A2C2E0C52F |
SHA-256 | 8A1AF54A8D10EC0C33F99FA67595B461E0BC94BF1A8BBDD773A1E41A47C92C64 |
Key | Value |
---|---|
FileSize | 558044 |
MD5 | 8EFC11166082C6E2EF7C474DFBBC2168 |
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 | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-3ubuntu1 |
SHA-1 | 783AEA0C77099ACBCCE2279DFF4844F48EE141EA |
SHA-256 | 1986A65620DF490F3A536BB77C2103976AEEF385E3D82E5860FE1E9484A0C0F6 |
Key | Value |
---|---|
FileSize | 545720 |
MD5 | F991CE45AC51FD2BF80AB1D920E2FA9A |
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 | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6ubuntu1 |
SHA-1 | 2B7A6016F55D6FD69A17BC58B1EDD4C7A3979FC9 |
SHA-256 | A581D5DA53AA9ACD8BC6E3B817174D29438871402C5262077CB28FC5B0673AC2 |
Key | Value |
---|---|
FileSize | 448012 |
MD5 | 2AEE1360C95ADF3F0CE41DA065078544 |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 2693352196F371F3FEBAA45784F0516314D2EB25 |
SHA-256 | DCC154121CA0481EF6448026A4EB9BC5900D0637A03F5DB55130B6FD54EC1422 |
Key | Value |
---|---|
FileSize | 565240 |
MD5 | 7D967AC03F566963F239E69AA2811067 |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 994AC39A6D6797EDD6684B5808ADE799728D70BA |
SHA-256 | 22B9AE388151A183E2619B0A6AB6EEFD12EBADC071F668974A8383F276557AC3 |
Key | Value |
---|---|
FileSize | 511932 |
MD5 | D67685E59D09AAD11617C71DB2FB28F3 |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | E9591FDE8830A2B0F40254743BA2299D01BD4BD0 |
SHA-256 | 5B68D2E846E3A126BFE789D40BA8BCDF0A2E26C6308F7163CD021171C818F251 |
Key | Value |
---|---|
FileSize | 449740 |
MD5 | 2365B749D04023D8E12A78617235B4CC |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | CFCD6BE03661AFA49F506EEC127CA4C8AA84A6E2 |
SHA-256 | DD5FD2C619504FA6F0D91DC9863AB17DE7E5265B15535B70BD2C596DBF6D1EE9 |
Key | Value |
---|---|
FileSize | 572504 |
MD5 | AF485B64D8D775D68832C4E6D291F41A |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | E4B1391B6856F6C001B503BE0E41278826E49AB5 |
SHA-256 | C6A5C65A1E808C57FAF721CD81228223DF41AFB78595B51C83463A8137BB1EBC |
Key | Value |
---|---|
FileSize | 554856 |
MD5 | 91CE861ADCB3094314101F5FDDEAAF0B |
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 | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-5ubuntu1 |
SHA-1 | A48F2E01E1CA5E882679D061D9074230DC6931C6 |
SHA-256 | 3A4872F8CE5B69F09D3B93A57B669307B720573E672E659BEFEC08E9DB4F0C41 |
Key | Value |
---|---|
FileSize | 523548 |
MD5 | 19B4BD3385CEE2A92D12ACBC8E08F109 |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 66AA26211F01434C327AB373683191F33174439C |
SHA-256 | E61F19F80456359254539B2FE29F8C9D22BA57E46BD94045BE86378AC134375B |
Key | Value |
---|---|
FileSize | 576216 |
MD5 | 30346AEF0AEE580C0513919BDCCF259B |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 07AC6E796C21FCAD8F91BBFBC38F2DCD2391C65B |
SHA-256 | 21EB3FF85C33B9675CA46D58F6E0FEC7EDED129C9946E417308D0AC9479B2239 |
Key | Value |
---|---|
FileSize | 513644 |
MD5 | D9CAF7798DD55EE2BCFF183169D0C2FD |
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 | python3-openbabel |
PackageSection | python |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 081F28A2D4F42BF10537C1DA41265936A0550ECA |
SHA-256 | 233BAA719991832B2291035E2343D3884B11CCBF7D177164FA33FFAE8D61ECB0 |