Key | Value |
---|---|
FileSize | 388000 |
MD5 | A4A45737B9E8771D1E48FEB4E42C5464 |
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 Chemistry::Openbabel, the Perl binding for Open Babel. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | libchemistry-openbabel-perl |
PackageSection | perl |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 2010C0A8F807730ADDCB20ADCE94629C30E6504F |
SHA-256 | 977AE6DEB16444ACA25C3779B398FBE8A02DFBD8CFBA073A689524FA6713BBDE |
hashlookup:children-total | 4 |
hashlookup:trust | 50 |
The searched file hash includes 4 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/lib64/perl5/vendor_perl/Chemistry/OpenBabel.pm |
FileSize | 251184 |
MD5 | 989A00D4A7B0EB1A70852208FE6C0A97 |
SHA-1 | BE225387DD75DAD71748DAEB799E963E973C0922 |
SHA-256 | 7378036F27B76FCD5B5DBA19D53F4F4D160A0E369483CDA4CA824799E61EA397 |
SSDEEP | 1536:XG3Ym691uh/ANfczbabtJMCHDobPbHrQheZ0/n1TzOgGpqSxdvivISizUtxZsGu+:X7EBgGpqSxXSXZkjW |
TLSH | T1DB347916CDC9932AC3D7643B5D4B60F1356DA8F60ACBE37AE6DE138C2B62AC45DE4005 |
Key | Value |
---|---|
FileName | ./usr/share/doc/python3-openbabel/copyright |
FileSize | 17605 |
MD5 | E40C7BBBEA95FC04DCC5DC820A090978 |
SHA-1 | 5BDAB0FB41D3854128475F76D935FEB081A9E0EB |
SHA-256 | 8BDFF9720D6BA37E04680A6B1CF167CBBB03E4EA5B349213C7798238ECCAD281 |
SSDEEP | 384:qMfbBd+hIGop3dbP9xb9Hb3HlMNoMN4tSQuMSthkZrs0rsxt5bRrSHtVZHU:q+bBd+hIGopxZHb3HlMNoMN4tSQuMStl |
TLSH | T1A682C60A2E4087BB3FD023D5394994DEE316739B322A5881704DD28A5F1B67A27F35E8 |
Key | Value |
---|---|
FileName | ./usr/lib/mipsel-linux-gnu/perl5/5.32/auto/Chemistry/OpenBabel/OpenBabel.so |
FileSize | 4656876 |
MD5 | 7554B3350FB10783395749ACB520D5D7 |
SHA-1 | 29F52EE4F628C7188305124E149FB25CAC714CF5 |
SHA-256 | B78E0D3C193E0B65102EF746E96F6FF98C8B4DA75D244D6B26E747B8CB32F573 |
SSDEEP | 49152:Cn6nbLhZ4ymxxVB3+jFYJmKmMlFMp5g8Lh/7c5m0VzL5LfLI2r1HHpA1SlqLMnW8:CnAo |
TLSH | T1A8263F015F446FA3E8D7CDB24A2E842204EEECBB59CD3E57B8A4C218715BC7D6C67618 |
Key | Value |
---|---|
FileName | ./usr/share/doc/python3-openbabel/changelog.Debian.gz |
FileSize | 9949 |
MD5 | A7639295AFD6F38FB8FEC6D9ECFC7BC4 |
SHA-1 | AB2B3A437FBD03DB4AA17CFB46B81E727319FF4A |
SHA-256 | EE7EB97584A4592EDBA7960A44DEC47E997AB2B61F3B25546A7FB24CEF2C9C3D |
SSDEEP | 192:DUbIXQJZ1ToEUxC6tMH0MxYF902/HT0XhKYUfd/bk+a65Zy8L4zInmRjBDtLVvAE:DkIXurvZkl9P0KHh9fdzDamsMTmRjBD/ |
TLSH | T1EE22D016B166E76A724B484FA0AF0E8CB0D532DFEDC1A2B05833147F74E40FB015D400 |