| Key | Value |
|---|---|
| FileSize | 3065194 |
| MD5 | 939C8B04377F7F4ADEDCB2F477009314 |
| PackageDescription | Chemical toolbox library Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It allows 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 shared library. |
| PackageMaintainer | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
| PackageName | libopenbabel4 |
| PackageSection | libs |
| PackageVersion | 2.3.0+dfsg-2ubuntu1 |
| SHA-1 | B5931DB7E52D05984CC332DFB06D00EEFC925C3E |
| SHA-256 | 295E88B7FF952BBC3332F74291B3D1558FABEB6335902AA5425F732A21839A28 |
| hashlookup:children-total | 146 |
| hashlookup:trust | 50 |
The searched file hash includes 146 children files known and seen by metalookup. A sample is included below:
| Key | Value |
|---|---|
| FileName | ./usr/lib/openbabel/2.3.0/ghemicalformat.so |
| FileSize | 18128 |
| MD5 | C540E565508A107E02F81DEF4CE19990 |
| SHA-1 | 00DDC96FAD27FA9DF1F8BFDBC805E2EBC67929FF |
| SHA-256 | 1C2DD0DD443889566248212B1D15087934A22FE446CCB88797B227C02CD83B88 |
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| TLSH | T15C82E8EDDF435D63CEB953B1208F0A603B29C89E7BD31B2F571B1009BEC29A99126594 |
| Key | Value |
|---|---|
| FileName | ./usr/lib/openbabel/2.3.0/pcmodelformat.so |
| FileSize | 18152 |
| MD5 | 220C0CCAB19783FF5E2A83CC94FE8651 |
| SHA-1 | 03462DE467335E47D7DEF885CB743F03C8E66DE6 |
| SHA-256 | DC7E74466D51E084D36CC134A5AFA14D1E6797E3892D7254E37E21E2C4B5D5A4 |
| SSDEEP | 384:AAN1I8gt65zuQHtmoSo7zBcfWk1Z59YHnRsyP4ulZGrl25535smCa:A6I8gku3MefjD59YHnRsyP4ulZGrl25H |
| TLSH | T144820AE8DF42A963CFF963B5509B0D213F2D889977D34F1B412B61056E42E9E8232F61 |
| Key | Value |
|---|---|
| FileName | ./usr/lib/openbabel/2.3.0/chemkinformat.so |
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| MD5 | A18274226DC973B648ED4B1FFE122351 |
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| SHA-256 | 1D5E3552DAF20410ECF0933F49966D687C05BCC68F5F07FCC59EF877C370E63A |
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| Key | Value |
|---|---|
| FileName | ./usr/lib/openbabel/2.3.0/mol2format.so |
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| db | nsrl_legacy |
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| source | modern.db |
| tar:gname | root |
| tar:uname | root |