Key | Value |
---|---|
FileSize | 2907892 |
MD5 | 97ACBF73AC46ECE480BF85714C650CA0 |
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 | 107914ADA2DB5CE49DAEBDB3D9C30AE11FA396B4 |
SHA-256 | 7B2E32DBB658F99C3CD2F45C315768085E0BE3A1372CA56CDF4F77DCBCAF7B88 |
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/s390x-linux-gnu/openbabel/3.1.1/pwscfformat.so |
FileSize | 31256 |
MD5 | 0E5E4CA1CC85A18B6A515E64D4CC82F6 |
SHA-1 | 060C48223471569524DD3C4E9264CECFE266085C |
SHA-256 | 86AEF17500F2290B488FD52D0BB0693EB0CF198892D715378B6001D31C32E3F6 |
SSDEEP | 384:MiqbZ7htDSEDDtJ71WL9k4gJ0Vrw8U4MDiNGnoYQKEhvYfil6Mn8nOHz:wL4a1WL960FhMDDoYEiilJ8nOH |
TLSH | T17CE2F9D37A31D979C9F42E77836F9AB1F2772C3836C8460667AF83151943F404A166E1 |
Key | Value |
---|---|
FileName | ./usr/lib/s390x-linux-gnu/openbabel/3.1.1/painterformat.so |
FileSize | 31200 |
MD5 | 95C6E07EDEFCE8E3260E867AB2DA25EA |
SHA-1 | 0662F8DB0730DCB55469220752416B2383B1E8FD |
SHA-256 | 19A8EA4715B4082761DBC18F6DC08F5C340697471A4344CCDB3F687D4F83CB4A |
SSDEEP | 384:pWGEDVYM9spaX7ARyjunEG71On9zmAFqYUjxw89zh4ea69xlTsoZF:pxMYM9spaER9nPKzbFPUjx19mVwtrZF |
TLSH | T1C2E2E9877F35DDA8DBF06A7B411F0A7267672C35BAE4965B57AEC30C0603F40C9256A0 |
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/s390x-linux-gnu/openbabel/3.1.1/lmpdatformat.so |
FileSize | 51904 |
MD5 | 50DDC4A24EE9BB303341995EDDA9E9AD |
SHA-1 | 071D4CFE323EF8F3B1B0D15874EB12BD2639ECED |
SHA-256 | F943EF62B91F491CBB3B9DBE8AE6B50736D5FF2811567D7A51FAEFE8CEF0F1D3 |
SSDEEP | 1536:YwRG9BT2SaOQ6Rqvm2OM8CiWnVF4Ana0F0v6:3Y9BtDbKVF4W7k6 |
TLSH | T169330AD7BD25E96AC0B07933D12F1EF7E1172C3527C96A09A6AECB260543F009929773 |
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/s390x-linux-gnu/openbabel/3.1.1/pdbqtformat.so |
FileSize | 93592 |
MD5 | 0B9CBC6AD24A03079F5FE89D36BECDC8 |
SHA-1 | 0BD7F2EED06A2C04968E06D4D772DCB7FAFCBAA9 |
SHA-256 | DD39B870D699A8B3D384463F54D1EFF130DDD7D9D00FCD1722F6335F67DAFD6A |
SSDEEP | 1536:eR+/WNR/9ShFSW4tKVxv3LKaFvzImLSG4GSJHVdkgXaa0hGC:etP9SWtADvzImLTS17Xaa0h |
TLSH | T1C1930997AF71CAA4C9F07E33915F6FB6D7272C346BCA5916A74DC3260943B004E28672 |
Key | Value |
---|---|
FileName | ./usr/lib/s390x-linux-gnu/openbabel/3.1.1/mpqcformat.so |
FileSize | 27072 |
MD5 | B37577D7B386DF2D7B57809F28D00525 |
SHA-1 | 0C54458A24C24DD24B03194F97C53C2F4B5E81D7 |
SHA-256 | 035ABC002121414A38DD5F579C0683D29D0BDFE6F277FED16A80E252EF5BCB39 |
SSDEEP | 384:2MNaWfuhEsfeH9FBettciBEv7P2hu+NnY:pcLeH9FcIiBEL2v6 |
TLSH | T1ECC2B7867F21D578DEF02A77408F4AB2B73B2C7876C96A4667EF83150903F444E25BA4 |
Key | Value |
---|---|
FileName | ./usr/lib/s390x-linux-gnu/openbabel/3.1.1/carformat.so |
FileSize | 27152 |
MD5 | 2DC9826C0F2B29A741407E5304FE9A1F |
SHA-1 | 0C5DF2AC86595FB6B589B8F411E188B9B1D933AA |
SHA-256 | E984DB4A5159517E07DAEFC0C8F96D997197EC655BF5BF614E61945152740B31 |
SSDEEP | 384:svio9hEDDtieT9K5+NXViltsjnOclAFj5u6k8EXZ8:MoT9dXVFlYU6k8EXZ8 |
TLSH | T19DC2C7833E21D578CAF43A77518F8AB1B7372C38B6C95646A3AEC3190903F048E65B95 |
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 |