Key | Value |
---|---|
FileSize | 750964 |
MD5 | A49B196EBBB449CE87830E675B3C60E1 |
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 the Perl binding. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | libchemistry-openbabel-perl |
PackageSection | perl |
PackageVersion | 2.3.2+dfsg-2 |
SHA-1 | 1E4128A0C3E0B45278AA46967E20F4CED518C157 |
SHA-256 | 8DE5517121A8B03E9916179CC935FAABC353E6F5ED8603C547FBB93122345EF7 |
hashlookup:children-total | 5 |
hashlookup:trust | 50 |
The searched file hash includes 5 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/share/doc/python-openbabel/changelog.gz |
FileSize | 148926 |
MD5 | 1E9E42753C21BB59FB3A20AC6B235202 |
SHA-1 | BDFDEA1C5C00D29B933251323265591FA4484BE8 |
SHA-256 | FF62C438849FB1A0EF53D4A0A2F681EE781DCC6964C9941257AB85ED699A758E |
SSDEEP | 3072:gwPrfTRuUAvg5+RxM0/5IJI1ayR6n9E6oEKRXMZrp+7D:rfYUAv6ExMOBV65oR9MZ07D |
TLSH | T154E3121991F1227091A7A5BDE3C7A98E4E8D550E3A38CE0FBF8D515B0365BE484C33E5 |
Key | Value |
---|---|
FileName | ./usr/share/doc/python-openbabel/changelog.Debian.gz |
FileSize | 6758 |
MD5 | E25CC0EFD00952BF22494C3A86DBE04A |
SHA-1 | 788F918803A5A6A4B18E8B3CE449A4932B2D0F2F |
SHA-256 | 1A3AE680F16E58A209339FF4508C6B096386EBF92702933489C13DFBFB934B72 |
SSDEEP | 192:Qkkvdzi4zjcpvHG1pbynuCSfW0NjMr84Hjm:jQdzvpbuTSuucfHjm |
TLSH | T1ECD17CE3E00696EBFAA31CE132C140986452231B915BAA6382DFF4CED955DFDA236181 |
Key | Value |
---|---|
FileName | ./usr/lib/arm-linux-gnueabi/perl5/5.20/auto/Chemistry/OpenBabel/OpenBabel.so |
FileSize | 3507244 |
MD5 | 7EA44D5DBAAC377075F8BEE8DD3A9213 |
SHA-1 | 38FB5A520E2B4844E6226AD91EF05F32C44FAF20 |
SHA-256 | 88AA4096AAFBACC7A38870FDA7556A5280B5273BCE37133F5BB1DB20D0A1D2B6 |
SSDEEP | 49152:F/kBdoKhB6b0vWMtqWPT7cnrca/c2AFE+xB2xNmS5Gw1t8TKIJmOmMyL5LfLd0VP:N0vWMtqWPK |
TLSH | T1EEF5F817ECE0FFB1C5C6537671AB81A47321B7B8A1C61A12D9A050283F27EDB487B359 |
Key | Value |
---|---|
FileName | ./usr/share/doc/python-openbabel/copyright |
FileSize | 12210 |
MD5 | 671E494037A190691DB732DD018226C6 |
SHA-1 | 1E28C421A071EFFCF7676E5C3984C7686A986109 |
SHA-256 | 46518C899A042FF6D2C9D00D8EDDDE6C5D040B62B286765A3879C6DAC3F7AD96 |
SSDEEP | 192:8l1B6d/RoIQ9h0QHnrRHb3HEMN4tSQuMSRR:EB6d/RoIQ9h0srRHb3HEMN4tSQuMSRR |
TLSH | T10F42C40E3D40C77B3AD023E1390950DEE327779B726D9491B04EC28A9B0AA7613F75E8 |
Key | Value |
---|---|
FileName | ./usr/lib/i386-linux-gnu/perl5/5.26/Chemistry/OpenBabel.pm |
FileSize | 268631 |
MD5 | 065BC4A20EC28998A2F32DA4FD5816F4 |
SHA-1 | D8D7173E833648CA0B075249015D5C8B236E239B |
SHA-256 | 0D959FF44C53BCCDBB30E9852AF04FFE59B1715AB48F145569F9CF7E083129A0 |
SSDEEP | 1536:9tGkYGWo3jg99zCdwFrh/ANfczbantJMS7HDobPbHEeZ0Nn1qzOgzpkOvivR6ScS:9tszCdwFZygzpksSNZD |
TLSH | T15E446916CDC9932AC3D7643B5D4B60F13529A8F64ACBE37AE6DE138C2B63AC45DE4005 |