Key | Value |
---|---|
FileSize | 5137464 |
MD5 | B12334A0C3693495F32BB10C77B0AE87 |
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 | 3.1.1+dfsg-6 |
SHA-1 | A183B5491CABAF38AC793584971BA0B37CA52614 |
SHA-256 | 532BD5196F1EACD371FB143E37D6BA2A35F7CC24828A667B6DAB3874E07F20CC |
hashlookup:children-total | 1613 |
hashlookup:trust | 50 |
The searched file hash includes 1613 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/typer_8h__dep__incl.png |
FileSize | 68764 |
MD5 | 81A4BD468BC64A13D8E65601836860A9 |
SHA-1 | 00755550101E5A9AB26B37B730B5BBD82CB5F1C0 |
SHA-256 | B27F2F1513D69CA59FA1319D368A26515D7411368AABDFA6EEC68E5081C91994 |
SSDEEP | 1536:7FTse0oAfeE8TXnwGpvKqwcNWleTZ2odPEqhylrn/usScXFmY:JQe0W3Xv3BYYPV9Xe |
TLSH | T10363F196F683CD2E8D7F0CD86456F07244536097C66D0875B1BE92ACFB7523A92E002F |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/matrix_8h__dep__incl.png |
FileSize | 2418 |
MD5 | 48517D603E3D27C16E5F52C076D6B75E |
SHA-1 | 007B4D1A88EBD7D4346A91E551D699603E9EA010 |
SHA-256 | 2E930CEDA1DC408A7FB552DF098810843A050D5C1AA7BBD102C104F4006D3715 |
SSDEEP | 48:v2VW/hQB1Aht7wwsaixZsA2ljV4zo3pHWwtFhRxuuiVuMC:v2ShQBmjsBihljV4zijtFhXcVW |
TLSH | T17A41F7D4D9C6DC7E1882853FAD9028F6F57936A91816F84700FFB8202CD00B86BD65B8 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/descriptor_8cpp.shtml |
FileSize | 4055 |
MD5 | 065F2E309DE86E73CCFD4F3408B89D6E |
SHA-1 | 008050306D63BBEE120FED2734EA3168F0512311 |
SHA-256 | E576D42DADF57B7996F2C188D8841385CF6D1EE3FBB55A2696D6D2260FC5B659 |
SSDEEP | 96:yJniwnyBq88C8f89lTrR2oLOThf0Mmi0tYnb:yJniwnyBrTg0RW |
TLSH | T12181932A9C89953BC5A345D2E3A1FBBD60C09955C3099814A4FC96D6A3C2ECEEE5720C |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1XMLBaseFormat__inherit__graph.map |
FileSize | 682 |
MD5 | 7F484D885A5E58E75DE5935D44F38A03 |
SHA-1 | 00B9AE5C21B54989C2B0CA7929986DF0F4801061 |
SHA-256 | 2C3870B0DA36D3284301C90E1B5BF4C78F8C092CECA95BE04B2F0C9C49F78C4A |
SSDEEP | 12:rNeTcQvFNWDT6tkEpQUNS7+39YTCpkEGF+WTmokEuDdWF8Pitl:rIp/aYL+iV6WLDWLLalol |
TLSH | T127014E0BD1959E3BB98600F4F2DD2D837B1943A0B7980D03B9F4E3344E81B64E42D749 |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/bindings_8h.shtml |
FileSize | 4919 |
MD5 | 420B657AFBE9DFFFA44A0AD5A12696E0 |
SHA-1 | 00D4442D3C2D8CFA05E56B9285C335386B529D14 |
SHA-256 | AAAB2BCB4B8780377AC74165BB6EE5D48890DDE76A74898973971571FE81A51B |
SSDEEP | 96:OMoJniwnyBq88C8f89lNc35MRHiHqjtJnhfHHmi0tYnb:0JniwnyBrNc3ANqW |
TLSH | T119A16329ACC656378DA321C3E252ABF960C04895C3855814FCFDB4A77385FCDEA5A10D |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/functions_y.shtml |
FileSize | 3058 |
MD5 | 45E0C7A92C8D73A904048031C49B3812 |
SHA-1 | 00F704288A1248CC961956F92C69D9D56BE6C7EE |
SHA-256 | 225646EAD1C2210B235C75350F97ABBF8DAD330DF751815A6989351E613B428E |
SSDEEP | 48:e1eqTvhniwny/blgSGm58KT8f899YYUIWUDkAdNuHfhvui01QIYW0b:gJniwnyB888C8f89iUD0Jmi0tYnb |
TLSH | T10851987DAC4A842BC39205D1F7A2A76890418855D3895CA4A1FC85E6B3C6F8EFD9E20D |
Key | Value |
---|---|
FileName | ./usr/share/doc/vg-docs/html/search/enumvalues_a.html |
FileSize | 1452 |
MD5 | EB9725889BB088584D7F6C38E381DFC0 |
RDS:package_id | 293681 |
SHA-1 | 00F92CE32D75C61A672FB90CC96823532D06A6A4 |
SHA-256 | 120E3FDB3C0263150D19AD5C97A368EA885C7507A58463F544907D041FD8F07C |
SHA-512 | 702A4889F8B70C992314A2B2CE45EF0FF35FD9C2A3B2BF9F6CABFF822A7F13312081737B9A41A6728159423FC670928F1F31018F792C82F7C9988DA566B618F0 |
SSDEEP | 24:hMYmlBrjvJpVvPwV4NOfHWBT/x/OMsk/xlRRpys+RRNysxX8ra4IuraDmYyfYnPX:7m33VnNOf04MRntys+xysxX8rtDrWmxm |
TLSH | T14231940B6C658812846641D8F0F6EB0F7CA5DE20A70EC8C814DCD5D7E1C6FE6CC297A5 |
insert-timestamp | 1727042844.4700274 |
mimetype | text/html |
source | snap:qGuUkQYxbDrEUxKy47h1svEpvOJsHaAJ_11 |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/functions_c.shtml |
FileSize | 24058 |
MD5 | 8ABE706551C50A41762570C360458507 |
SHA-1 | 016843E2D2FFD9661CB4AD6AE0818A3830CB5E59 |
SHA-256 | 99F8D7539ED244C58963659E071B8A780D2BFDFD0A2E4DEB205E585CFEC92192 |
SSDEEP | 384:gJnHnyhG5buIhcY3Byu1Xz8D1wCZwcXNyQO/E/k28zt:+nHyhOhcY3Byu1j8DAANdOg4 |
TLSH | T10DB21F34CD518E36C3CB72568B9BA77436A30EE1E5C41AA7FDE8D9812701F45AF5820E |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/classOpenBabel_1_1OBVectorData.shtml |
FileSize | 30078 |
MD5 | 7C773C9C5DF2A12CCE07498AFAD535D4 |
SHA-1 | 017C7B8397034AFA358859BFEBA1870757653A1B |
SHA-256 | AA8097D6A111D1B3B09665A60BA438C40C0EBDA5266773EC17462F516732C501 |
SSDEEP | 384:YJnHnyb1JOwjcTEt2T4MqUiQtTt4NqBjjqmEPCBb2PiVgMU6PtUCaK:GnHyb2kW4KB4AYXPCBb71vVTJ |
TLSH | T1BAD21F20D8D32637CAD770D3875AAFB271D108AAD7820945F5FDAAE60B48E84F61741F |
Key | Value |
---|---|
FileName | ./usr/share/doc/libopenbabel-dev/html/formula.repository |
FileSize | 372 |
MD5 | BC1A1D748FF442A17594F275763685A7 |
SHA-1 | 01D2C6510C80AF7BCAF13F61AA1F8052888B9623 |
SHA-256 | 066ED4F7511B92D922EC33286F127F2F25D86B4E47666C81534B52E974A1CB59 |
SSDEEP | 6:KKx+ssD+z3p3aFhKlDBeG6VdfC69j/oV5DzxicdfvA5Td6sTs6Pf+kv:KKPsD+zZ3aFsRG3K6QxT2dd6sTsE+kv |
TLSH | T1FEE04F826D4522D420328F2FD0C8770BD70261C6E8EB15B25F19E26BEAE20D3CE15299 |