Key | Value |
---|---|
FileSize | 3289056 |
MD5 | FF8BDD2249C8880222AACD32EC55ECBC |
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 | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | libopenbabel-doc |
PackageSection | doc |
PackageVersion | 2.4.1+dfsg-3 |
SHA-1 | CDF59A3B2A5CB24EB432160AC75F2798D7ABE83A |
SHA-256 | 61DAE0B160F088BB708329AD0D2CD05E00C5378F61395D37C8A30AACCFD8C4F8 |
hashlookup:children-total | 1166 |
hashlookup:trust | 50 |
The searched file hash includes 1166 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/chains_8h_source.shtml.gz |
FileSize | 3929 |
MD5 | 855944D3DA571ABBB6B0255CD16C1BEC |
SHA-1 | 000A56783F3A8AC3B591F9899751292A2206E6AD |
SHA-256 | CB12340EBBC1F26C06398F5EEBD7C053836AEC2E0D386DBDCC288A6884A9CB0E |
SSDEEP | 96:uKDstZqZAZOBUTPCXYlmiF3h0fUk6NYRSRaBmA3Qomgyzp:TDstROBaiYlj9hCosXBmA36gyzp |
TLSH | T13A814D040E63127852712FEF532380CB0EEC45EA6CB799146F9E46A7787135631CF4B2 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBResidue.png |
FileSize | 396 |
MD5 | A51104D5F6E1219F847C7688E99A2B1B |
SHA-1 | 003301226A363830A25AF26553508D8911A90F6B |
SHA-256 | D81E27FF51E27F22035E1C633FA3CF6D3809B07F56CAD99CBDBC00C10BBD221B |
SSDEEP | 12:6v/7dQXWlR+dn3EJUKjqD3pSIEvMz9ms+zyA:QQXWlRAfpOMzgscyA |
TLSH | T10EE0F1ED4B71DC60FE9A54431102C07299F6149429A4671B1330631508B1744C1C7342 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/dir_aabfc5907fabda9e6b87df21134395b8.shtml.gz |
FileSize | 2592 |
MD5 | 92FF20EE8404395BFA16424D99694B1D |
SHA-1 | 005E67775C4DE69A503D480CCFF5DED2D2DC2ACB |
SHA-256 | 15062A311E989556A78C4C9F67EB56022C26688F33C3172DF47314B5CFD16311 |
SSDEEP | 48:XERL31euzDMNjnMqKDleKfcj7awyv0qqj81c2HJvRG8m41OUXk5/9tjAH:CLsiMKDDcKf06cL8vXZXK3e |
TLSH | T142513AB59E9710EA687FFF2B09A2200DF231B40497AADB0F9A11A00A2A17C84E109523 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/functions_func_f.shtml.gz |
FileSize | 2873 |
MD5 | 7D5BF46FC46D02177BFBC133ED588086 |
SHA-1 | 006B1F7A54512867F020562385B31F14274C52F5 |
SHA-256 | F4F5250F4C23957347089F2114490194E6356B48B361611666737CE76BB3CEEF |
SSDEEP | 48:X7EcYFnWZ+iOyg1lw6G1+TVoSyY2U+YcL4sa6Tn8r5CSLcDEb/Xrr:LEtFn6gZcIVLy0+38sa6T3orn |
TLSH | T1F5513B480F0D53030DCA879AD07E97CFB5D535659F9C99CCF9ABA40066D09760182734 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBFreeGrid-members.shtml.gz |
FileSize | 2166 |
MD5 | 0BFF1DA97E2CB674705AF8D70C3B4C76 |
SHA-1 | 00B848FBC7CA1257818631356CE25F8EA51AC107 |
SHA-256 | EEECD5774D22DC83AA3AE01E8D1E68787BBF5420FF793FCB7EE7C1C36B1C50FB |
SSDEEP | 48:X3ezz02avaOR+rchbHJ/s31rSeDf/OtVYYuQCBefcyxMz1ePJe:+kvaOR+r8HVytAVVAvYMzYs |
TLSH | T10D413CF4403E569685CCCDD875E1F44B8DC8AAF39AD0E937020143D00D695AEDA9C99A |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1obLogBuf.png |
FileSize | 400 |
MD5 | AD07970EE5A505E2427713777C2B0D71 |
SHA-1 | 014245E99F151C6011FD526E089A97C1249AFF3E |
SHA-256 | A4B3FDDC79B9976FA566742636F3DC22FAA101447DE64A098F445D1F4365F5B8 |
SSDEEP | 12:6v/7yAWlR+/5pUa+aYcbySe95haXyb+7Qcq0UDje:rAWlRy56AYcbs5Y0Dje |
TLSH | T1E7E0F19BB130EE30F0608961B665D1812EAC2E110BBD4127A499F5403BB3288E7D9841 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/functions_y.shtml |
FileSize | 2812 |
MD5 | A4D02689402B71F9BE1D2F7578F191BE |
SHA-1 | 017C00BE8047C8490517F6A5F64F2DEAD35541FF |
SHA-256 | FA9219DA7CA48158F87FD18EBC1BBE1C212C83B6E5D3D0C81722B7BBAECD405D |
SSDEEP | 48:e1eqXwniwE/bXXSGm58KT8f899YYUIWUDkAdNuHfhvuei01QIYWHs2:1niwEt88C8f89iUD0Jmei0tYAs2 |
TLSH | T13E51763DAC0A852BC2A20581F3E1B6A4D0918955D3859C64E1FD85A6B3C2FCEFD9E24D |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBError-members.shtml.gz |
FileSize | 1935 |
MD5 | 5426032444828955C23D4F7AED3AB3FA |
SHA-1 | 019CB3679E206F78DECE1F6D0538C21C2071D704 |
SHA-256 | 1C403F370437FCA657FF3B5232A29451BA3E02F6E64155F9008566BEA00B23BE |
SSDEEP | 48:Xq4hzkcXkKWZJW1bVbMXISmZBH+An2ZyZ1PLUDusafv:tWcOJWQInVF2ZyZ1qafv |
TLSH | T19C413BC6062C1EB7E7DA565C4FCABE35E66D53A950A030BBA2E2687C23F3B6D40005D4 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/obconversion_readstring_8cpp-example.shtml.gz |
FileSize | 1525 |
MD5 | 6DD80D143A676E13B16EBF0DCE41181C |
SHA-1 | 01C4DB4E2D9C35EE21C3BA597417FCF1A9A92BB2 |
SHA-256 | F52146720EE83ECE818DD94F450F0202466189496EE8D5761F167BC8D7AE5560 |
SSDEEP | 24:XblngJbuwgELuiCJBBAxZbfEdFlkJDnO0ZeRaDI5B9Lm0coZiVamHkQf1iYKFm:Xb1gBuw1LHwWHEHlyDndZek43Lm6NSwm |
TLSH | T185310A7485427EB5C28E39FA810199EB90A40442CA971CADF5C86FE5D16600E6A462CF |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/structOpenBabel_1_1detail_1_1max__value_3_01T_00_010_01_4.shtml.gz |
FileSize | 1791 |
MD5 | D6C335C708A790AAF62BB5F1BDF9E70A |
SHA-1 | 021F86BE3C94926CA2429D0E2A5D40942AA739C5 |
SHA-256 | 43EFBF228B5E3B8D80486DD85568E95FB6CD32F4F8CC033FC150FF294CDC0951 |
SSDEEP | 48:XcttwvJsvCy4tOK5O40P9+JEcEUb2MO01+UUjB64uFYP:MtwxdyhKe9oEcEDMOW+fBDP |
TLSH | T1C231E99AA04498B3B0642BCED7E057A0B9B92537801AB6C5473C6EADF1890D38A21C19 |