Key | Value |
---|---|
FileSize | 2921348 |
MD5 | C4F3651A8AC55971C10103AFF9C3C95A |
PackageDescription | Chemical toolbox library 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 shared library. |
PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
PackageName | libopenbabel7 |
PackageSection | libs |
PackageVersion | 3.1.1+dfsg-6 |
SHA-1 | 49FF376664DF8C211E7DC19C83CEC841DEADD089 |
SHA-256 | 75016AEC385B9519579364CF6CF6ED2C31F10F5E7A0A9DE41E2AB814304A3883 |
hashlookup:children-total | 186 |
hashlookup:trust | 50 |
The searched file hash includes 186 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/lib/mips64el-linux-gnuabi64/openbabel/3.1.1/mdlformat.so |
FileSize | 156368 |
MD5 | DD74F617A9AF7946B072466DA902CD8A |
SHA-1 | 0347AB0B460951E3D55C0C16AEB10D56B75B3FA1 |
SHA-256 | 564E23F5A6B4279AA0051738985CF2619A90AC6C24B13F93CD91FE0336A3443E |
SSDEEP | 1536:mqoLukNLzGroCe5kFgV9jF/HkK/m+5PPMFHYfokCQs8Xj9B6nhV6svHQA:mXyzrZZ2V9ZRflEF4ffYo |
TLSH | T19EE32C42DF052F32EAD6CF324D3F9173271E6C5B67904707AD6D654A2E23A8A0F82B45 |
Key | Value |
---|---|
FileName | ./usr/lib/mips64el-linux-gnuabi64/openbabel/3.1.1/molproformat.so |
FileSize | 50312 |
MD5 | EAF4EECE572A65FC0C5172B99479162B |
SHA-1 | 05EC018CF6C2560722935D0B9C69A53F4F1D5986 |
SHA-256 | 16172303CE48CE3604DA53B3DAF75783BD1EB9B71539DA21F55A70A45FE5C59B |
SSDEEP | 768:Byor+hfTry9stY14GPJaQSEPnY6vF7g8FLcohlaU:0or+hbry9sa+GPJaQSEPJ7g8FQohlr |
TLSH | T1A9330C13EF095F35D9EFCE32883FD0B6272E2C9762844B17AD595B485E22E8D0F92641 |
Key | Value |
---|---|
CRC32 | 0B300A64 |
FileName | snap-hashlookup-import/usr/share/openbabel/3.1.0/torlib.txt |
FileSize | 9963 |
MD5 | C7BDA1C80C0F535B15BF2B7704CA3F45 |
OpSystemCode | 362 |
ProductCode | 220927 |
RDS:package_id | 263834 |
SHA-1 | 06AD67D93E58B1A00C655B7D8C366DE5A7ECA054 |
SHA-256 | F3B2DF788EF0A7DCA48CF7ED336BD4C3D72055B7EF95294A124A8E37F9791435 |
SHA-512 | DCCC0658CE45B7805E30DD83BE050092E674A82F496D1BA1C7743AC2276CE1D173B4B0A577E11E7FC3ABD9C2647E7E74DBA6B497A31056E89080DE5B9F13F263 |
SSDEEP | 192:yOjk5sCAWJ5oNlte7htKbl2Z71KUU5a7aMDQu1ZRg3g:VkgWJhdtKIMUuu1r |
SpecialCode | |
TLSH | T18622F2347C093B2453EDCAC908366AF14E7CFB9B7E0F6521BD8EA86057987D9C859C06 |
db | nsrl_modern_rds |
insert-timestamp | 1728201805.312596 |
mimetype | text/plain |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_105 |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | ./usr/lib/mips64el-linux-gnuabi64/openbabel/3.1.1/gausscubeformat.so |
FileSize | 70464 |
MD5 | 12765F4B8F07B9805344784EE5E71B3A |
SHA-1 | 073027EFA659DD9988D68CB13D16BD65FB5F8646 |
SHA-256 | 9BC148F2CCF3F804E26C8A5A380F8741018AC38C63D02C1F539677BCBE5D60ED |
SSDEEP | 1536:etGtxz+bl7e9eDb0O2shVL0c11ypCUK+jJQllEAzUpEJgw8+oe9H:JXw7e99jse+J |
TLSH | T143630A33AB041F21DED7AF72483FD2A1663E2C1776501A03ED6E92084DB79D58FE6A44 |
Key | Value |
---|---|
CRC32 | CA76F417 |
FileName | ./usr/share/openbabel/2.4.1/atomtyp.txt |
FileSize | 10155 |
MD5 | 60C777DDCDDF90D0269AAF0263EDFE14 |
OpSystemCode | 362 |
ProductCode | 220927 |
RDS:package_id | 263834 |
SHA-1 | 082678951146C04915BF5201E55D22AFEBCC1E50 |
SHA-256 | 78E52637266CA914232A64F4979B03E0BC8BE0A91B7036EC38039F2876BE080A |
SHA-512 | D01C14BF240B05E455F28BC6CCBB265A25DE0F744418459800842C234C33D530CD6DED78E969866F7CDCDEC0817A0ADF2CE179D91CA7DB892B3FEC4FBB79A61F |
SSDEEP | 96:pc7oCWkdbttazfi6UzFNWiR+/zQX0OsjruaPyOM8RXfl9QGBCpv16uJVCXOwCdS6:CLNGzqvpNf2zES7DMel8tg9L+J/ |
SpecialCode | |
TLSH | T12522BD50685AB34E2337968BD51BD58451B8D72A8EEB049C382FC941837093BEFDD62F |
db | nsrl_modern_rds |
insert-timestamp | 1728201804.9759884 |
mimetype | text/plain |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_105 |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | ./usr/lib/mips64el-linux-gnuabi64/openbabel/3.1.1/gaussformat.so |
FileSize | 130936 |
MD5 | F9A51D66DB4AD969B6AAE446D9176483 |
SHA-1 | 09EEC541AF9F5B946821E7DBF9E87D2BE24E7646 |
SHA-256 | ACA48E7CBAD32945126E01BAFE4B014922D32B33ACCC79D502E394431DB70DAE |
SSDEEP | 3072:dynQ7xXV9JyvRddYmtYzYYhAFYYKkRz4BwcEc:qQdV9EvfU/ |
TLSH | T135D3D7936F492E11C9D5DF72AE6BB0F6272E1C8B12C40F177F1D4E499E17B890E81A06 |
Key | Value |
---|---|
FileName | ./usr/lib/mips64el-linux-gnuabi64/openbabel/3.1.1/pdbqtformat.so |
FileSize | 100584 |
MD5 | E92299599C15575F09C2E8C70343BE2B |
SHA-1 | 0B7AFD91A11A29D3EDB553D26C71986364BCD11F |
SHA-256 | EA9892559E639BCFB05EF6ABC16AC6D4CF75DB919DDC92A429C1DDF819310815 |
SSDEEP | 1536:DmyevydN5F9268xq9iMV6IyXmwBNBzQCsLGunpwKzgArU5dStggNtN2KcqQ/aa0:5eEF9jinZzQCsLGxeCAaqGaa0 |
TLSH | T151A33B47AF467F70E6D6CF72892F81B2273E2C97B2924B53AE694D489D079CC0D86740 |
Key | Value |
---|---|
FileName | ./usr/lib/mips64el-linux-gnuabi64/openbabel/3.1.1/asciiformat.so |
FileSize | 42160 |
MD5 | 8FD0CB0BBF243A0A8E904F12FEEFBD85 |
SHA-1 | 0C6B7E3BF103A9CD11AB1EE1EAACAB32A84CBDC3 |
SHA-256 | 13122F67648894E0A0E63FD1E49051A16862D3E0C79F9CD45E19AF2F0E86DE7C |
SSDEEP | 768:FDwSv46dhGGS9QUTh5CBIPPnScZBalG+Pndzw9NIka:FDwSv1dhGGS9QUt4KPfjDD+Rka |
TLSH | T1DB13F883BF457F36C9E5CE32401FD6721B3F1C9AA3C1461BB99C964D5F22B898E42A44 |
Key | Value |
---|---|
CRC32 | 11A7344C |
FileName | ./usr/share/openbabel/2.4.1/plugindefines.txt |
FileSize | 2400 |
MD5 | EB8C0673C4975081B3F54AA1D5E51667 |
OpSystemCode | 362 |
ProductCode | 220927 |
RDS:package_id | 263834 |
SHA-1 | 0CE42ADC19C51C2BBF51E079E111809BEC138982 |
SHA-256 | 5E829D7D047D25B1CC764A2738004F866832408565AC1BE6E95F7CE750B98FB5 |
SHA-512 | B2C0AF2A8FCBA4B63A227C897E59649E1527688C7CEBE64BAAA55924BDDDEC5ABC1FB375AE63D218D0989832A2F62BBB4FD023A6019DAB31BCE3D8B505FE52A6 |
SSDEEP | 48:hvcPBqdY1EXhCmPTv+wymASm+XBMoqWBgXYlLjMBaf8xLkAw5:h0ZqdYyhC25zrxmIZzfl5 |
SpecialCode | |
TLSH | T1D54164012C01D2AF04C501E17FAFA345D764B72B1AC1589AF4FCC16527C3AF2E6B5B94 |
db | nsrl_modern_rds |
insert-timestamp | 1728201805.1190357 |
mimetype | text/plain |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_105 |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | snap-hashlookup-import/usr/share/openbabel/3.1.0/types.txt |
FileSize | 10975 |
MD5 | F0960A48E248AC7ED906B315F6928290 |
RDS:package_id | 263834 |
SHA-1 | 0DE084E091A0C27E605372C1AD4EF4A52E5EF754 |
SHA-256 | 164D02DA573ED800441412380E163889BC7E0063657EA0F7CDC14E00C13965AC |
SHA-512 | 2DE8DE1787E3BF8E7B23CAF242315E42826E7177D997C737DC467CA1D4CFEB52EA60ECB197EFF6B67AB1684DF43A2D6AE5774F1BA7EEBF97B68D28F889B2564A |
SSDEEP | 192:s1JVJmc0cX3OA3EOU39sjNsYo8sBs3ekKFi4tGWGvq4MTgHxMOPwe6XTVBvFFiP:mJTmN03OA3EOU39sjNsT8sBs3DKE4tri |
TLSH | T1B332C940BC4021158BB8CA1356F6CBBA062C697D7C236F4AB91CE2A57F72B0765B14CE |
insert-timestamp | 1728201805.3576157 |
mimetype | text/plain |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_105 |
tar:gname | root |
tar:uname | root |