Key | Value |
---|---|
FileSize | 7442760 |
MD5 | 0175A69E9FE9C89FC00DC594A11409BA |
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 | 3.1.1+dfsg-3ubuntu1 |
SHA-1 | 99C7835A7BD292CE5C954426FB0D92D5AD1E9622 |
SHA-256 | F9C06A129B7E6121F856D79D1FA71EBE2DAD9EAD0A23C80AD785BFC7B4E384D0 |
hashlookup:children-total | 1605 |
hashlookup:trust | 50 |
The searched file hash includes 1605 children files known and seen by metalookup. A sample is included below:
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/namespacemembers_func_d.shtml.gz |
FileSize | 1676 |
MD5 | 809ADF3541D811023355AB79033BBFFB |
SHA-1 | 00F3D5A3B2A918EAA87136EB9A6E4F44EA270776 |
SHA-256 | 6E4A9FC18C6D8B01FDFEE6EE60BC1AE62930972ABFF3270DCBB992AF73F807C6 |
SSDEEP | 48:XvRsK7TeboFD4WyhiMRoQNVUZ29/KCGEUdL:fw6uhiI/Um/0L |
TLSH | T116311DD11101AD3490753F7535C119BD0ECA81C0EAA07C1EEBEB033C914DDE59B31624 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/kekulize_8cpp.shtml.gz |
FileSize | 1915 |
MD5 | 008A38852AD69C3756F1CEA7FD76F945 |
SHA-1 | 010C82336626A2B162EA30BB448099FD048A7178 |
SHA-256 | 27CF9461D791A606895D29F81C94527CA81AAA10EAB3525E640596D965C9A3A8 |
SSDEEP | 48:XS2MD6s807oc7FOeeGbAjjeIi9ppCWYTupyiIx+kOT:jMD6sLvOhuAWIi9pTYo |
TLSH | T1EE411DF7DAE52A135293AC5A846B5B380074652D3E3B0D14290FD4D474158A785E705C |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBChargeModel-members.shtml.gz |
FileSize | 2741 |
MD5 | 7FF5AED6A87385EE3BE7478BABC0345B |
SHA-1 | 01105CA76B27C27D13A80F65CD1C9331E42E821F |
SHA-256 | 50A8CB3A0AC7476077BC368904BCA6999A1C329661BABDC41D7F8E177877D9E6 |
SSDEEP | 48:XAkRrd4JzZ8h5bQ2q/PTf5tE4NxW1hdPhMWi8lMwcD4Te:Qi4h6dmPT5la1L2b6K4Te |
TLSH | T1DA514BD0AE27DD9C3DB0B2A0EC2561B85B5CFCC7A815CFD264D80D06B24A88F54FA984 |
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/kekulize_8h.shtml.gz |
FileSize | 1859 |
MD5 | 35378EA2C65E230F70B69CA95A9EB60E |
SHA-1 | 015BB821A2645BCF674CF281C84F969361DD2B15 |
SHA-256 | 4EFD04E4433E25C5C9CEDB450C30E368B8C6137B985B4983B29ACEC15DE7ACF8 |
SSDEEP | 48:XeKqzGYP+AWxmqmX9iJEEkWNha372I9SdA4HOMjxd:OKsGYQK2NkGWyhJdd |
TLSH | T124313B8345CC69D649AC186454A5934AD4E5C2B40EAA2917FA34A0E86B10ED7092E71F |
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/graphsym_8h__dep__incl.md5 |
FileSize | 32 |
MD5 | 9467152C6DBCDE6173CDD48AF0E2E3BE |
SHA-1 | 01D474563ED7DA6D8833ABDB9531A16710718746 |
SHA-256 | 8D274F127D8A3631DFC74B814A5E8F9A4A2F1100C1D01E21CD3B8CC274429BB2 |
SSDEEP | 3:AsYsTBYdCn:As3BYUn |
TLSH |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBRingData__inherit__graph.map |
FileSize | 318 |
MD5 | F2B793F0B5DAE784F01A5F450F486C21 |
SHA-1 | 01E851E2BECBFE937B8C51CFF75373E855E1E2E5 |
SHA-256 | 2110BA8C3CD5026D3F9444F2073FD4B20B9051BAC18F47CAB3DDAEF9079699E2 |
SSDEEP | 6:rwanRJanRaQTIrUkFdDH6buv2ApjQTCpNuEziPioWi26GdQve:rwanunBTcUkfb65jTCpkEMiGql |
TLSH | T1DDE07D2551208E3F7A070571E2C8DE839280029453C8171558C4D5258C42DB0F12955A |