Key | Value |
---|---|
FileSize | 7368060 |
MD5 | 823A0E0FBDC1C3F8D9B3D7FDA971F79E |
PackageDescription | Chemical toolbox library (documentation) 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 library documentation. |
PackageMaintainer | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | libopenbabel-doc |
PackageSection | doc |
PackageVersion | 3.0.0+dfsg-3ubuntu3 |
SHA-1 | 1735352794D30257C51E013E7D5454B79BF37ED0 |
SHA-256 | FCE6EC4DE84E0E6390C616186D56B65AB75613D14C3D3C12C872337F8B133376 |
hashlookup:children-total | 1596 |
hashlookup:trust | 50 |
The searched file hash includes 1596 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/globals_z.shtml |
FileSize | 2826 |
MD5 | 18A35D785DB85D5072FF250916C17F76 |
SHA-1 | 002EBFBABD926A0BCFD88B0FC823133EC4712E6D |
SHA-256 | 7E54D388F95440AB46124BC650BB22DFBC11D3BD173EE0709CF465AC18B78529 |
SSDEEP | 48:e1mqlv5niwny/blgSGm58KT8f8992yVt6fhvuB01QIYWqD:qBniwnyB888C8f89wmB0tYRD |
TLSH | T11551B96D6C4A842B82A10981F3F2A7ACC044991497899C6470FC85E6B3C6ECEFD9E34C |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBProxGrid__inherit__graph.png |
FileSize | 4469 |
MD5 | 057175CEBE09033BF352F2253DB14166 |
SHA-1 | 0085476D2F85FD7D0F6733E7FBD4B9340A6B33FE |
SHA-256 | A3F0AB6F25439061DA16991DB77AB2FBD31D7A4BF6005183BCF68B66B964467C |
SSDEEP | 96:X8NN2F0eCU+cMJCP++7TTBX8P+kvwDjtyZrboBGRxsmHQ:XY2uRU+DJCPDVe+k8tUryGRCMQ |
TLSH | T1D7914BB2098039515E50A7C75AFDDF52D31B53B31CE45AD4801F5E11EB4E68C8EFC981 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/mainclasses.shtml.gz |
FileSize | 4311 |
MD5 | 51CDC846569565EAE0D340BF8DCF2044 |
SHA-1 | 00F5BEB6954876CC379C3A0E3CC679404266732D |
SHA-256 | 1A0EA244DCC9C89D46262F2C71026D91B3BE64AE7BBC48C8EB9C2DC7DB827028 |
SSDEEP | 96:h5/s0yo3EbB2ukjnhP8Ciz4mcQ9gXAD4aKzQgVA5:LsjN2uOhdQcQ9gxaKzrM |
TLSH | T187916C09BF9D0220D99C2BD9C0B43B04877532234FAC188FB697E5CCAD361A26A99006 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1CommandPainter.shtml.gz |
FileSize | 4581 |
MD5 | A91EF8939D4ABFCD84DD4C2008C36A21 |
SHA-1 | 01156CA100BC6B2782E5AF2FCBC3498AAD296CD0 |
SHA-256 | FCCCE4AA03A51514CF49E632EF50DE90CE03C302201FCAC4A8092272662519BB |
SSDEEP | 96:Zb5kLENep9AX4jEnyBA5ehti45m57/UfBWQZ6l8UyT7xqlPKzHB/vK1Whg:95rcpgCvm5ehtP5m5YZb4WUNPKHB/S1R |
TLSH | T1DF919D5C8A2CE100FE741E47E7963AA31FBC3A9B2A04219C849C79B73C6F0CB9146370 |
Key | Value |
---|---|
FileName | ./usr/share/doc/wx3.0-doc/html/search/enumvalues_8.html |
FileSize | 1263 |
MD5 | 8FFDFE4623DC4A5FD0984F226BA71BFF |
SHA-1 | 011D5A9F32CF88D92CCBCAF3A2432640EA335D30 |
SHA-256 | DC0A724B1EA67C9C91F517B7C83D054DDDEC3EDBF39EE92DD539E661F932A0C2 |
SSDEEP | 24:hMYmArjJgVvPwV4NOfHWBTytxvpOMskytxlRRpys+RRNysxX8ra4I0p4X:7mmOnNOfhtSMwtntys+xysxX8rtsX |
TLSH | T1592110475CA18956885141D8F0F1EB2FBC69DE34670EC8D800EC91D7D195FD5CC197A9 |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/alias_8h__dep__incl.map |
FileSize | 696 |
MD5 | B832C4B03D18F461EF54D489A17A4900 |
SHA-1 | 0153FC8771B7BE2ECBFAD78C1126EF4597228E95 |
SHA-256 | AC2D7C73F573839245939BCC75C1CD52E0B6B91EE6DBB8C19C11629C28926B41 |
SSDEEP | 12:rLRhaTcbmLkgqFW6V5d8WTCwmLkgqFW6V57HTmsbZmKG7T6W75G4uvNgb:rLmumE5+W9mE5ztmJJ7evs |
TLSH | T1A601472661305E36680F04F862CDAD039A83AB2053CC0F0574909225DC89B6CA62E72E |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBAtomTyper__inherit__graph.png |
FileSize | 4014 |
MD5 | 892C73BC70B42175DB7BCD41D9325316 |
SHA-1 | 016D8A5A7CB015B97C8609D6A5F75E5F85C6E450 |
SHA-256 | 2D452C79DE8C1339FBC8B4559ACBAF8283EA4AAA4FCBD4FE7F8B4767F723BB6A |
SSDEEP | 96:CLOqD1xbS266zHqpCnwbASflgDd3nac8NLVSbSW:zI1x7qpew9+DhncwbSW |
TLSH | T196816C68A0A51CFB3D53168C38E7DF4C52BCD25C822EA0CD84521ABC22064D197ECFEA |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/structOpenBabel_1_1OBTetrahedralConfig-members.shtml.gz |
FileSize | 1721 |
MD5 | 05A2D42D296A937DDD02622FB964EA6D |
SHA-1 | 019716CAAE849E83178FCEB2C414A0163E49B846 |
SHA-256 | C15448531EE03E280A75FB9DA7C793DEFD355B6EB9BA32A4EA287A9E8FC8501C |
SSDEEP | 48:Xf+APkz7muVO1om4MUR8pUjefyQy2gP1yNRh:LPkzqukmmzg18yQOEvh |
TLSH | T1C5314DAC78E525CBE9DA93304284D37D9EB653A40075D07C011DB4144432975FF2CC26 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/reactionfacade_8h.shtml.gz |
FileSize | 2029 |
MD5 | 963CF2946F2888A4BA2A4316C194B97E |
SHA-1 | 01CF4233192B394B7D24586C1DF9347DC41EF881 |
SHA-256 | B62C875E39C2445E68600097BDD35E1CF1A475A830857D594DFE9CFA4FE4B7FE |
SSDEEP | 48:XqG/oYpeHdKPGEPpNfR86rQ/yDUJoC5G0EaH:GYwHmRNJ86rQaZCSo |
TLSH | T109410A133A705F08C9FA4F2421AD562B372B25A64EAB3B920B0BCFA008D052A9E9D545 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/graphsym_8h__dep__incl.md5 |
FileSize | 32 |
MD5 | 9467152C6DBCDE6173CDD48AF0E2E3BE |
SHA-1 | 01D474563ED7DA6D8833ABDB9531A16710718746 |
SHA-256 | 8D274F127D8A3631DFC74B814A5E8F9A4A2F1100C1D01E21CD3B8CC274429BB2 |
SSDEEP | 3:AsYsTBYdCn:As3BYUn |
TLSH |