Key | Value |
---|---|
FileSize | 3276720 |
MD5 | B37965481023ED984C1B00DE4EE92C19 |
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 | 20159332D3BA3B17DC014D2A9D4B3AEBD0DE3F37 |
SHA-256 | 64F849B7BB22C22ECA7147144258F5CEDECB89EC27D40C0732E9F5CF0D439F37 |
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/i386-linux-gnu/openbabel/3.1.1/fchkformat.so |
FileSize | 71540 |
MD5 | 5369C8E422911F997CA4ED494DCE906B |
SHA-1 | 0007CA9C70B11735CE6CF2EA785B0F693D426411 |
SHA-256 | 4F7D324C1F7ECBAD1D8329B1F9E17E8673D1A357F8500745C2D0CFDD7BF77ED9 |
SSDEEP | 1536:Z5FLtvfV9utXKWRXXfTy7VOp/1b0+GqXWmqW:ZLVfV9u1TRXXfu7lqmzW |
TLSH | T10B631842FF52FA76DAA331BD2207D7713411AD72B087A283F644AB4966B0AD05D16F33 |
Key | Value |
---|---|
FileName | ./usr/lib/i386-linux-gnu/openbabel/3.1.1/wlnformat.so |
FileSize | 79668 |
MD5 | 7E98740F335F9A67F5589BC1656A744E |
SHA-1 | 00EC639DD9AA87C0F56E0CA8D1F7AE70802C0AA1 |
SHA-256 | 4431E4E631D837B19D7DA1ECFCC136F695A92C00BE185F342B3FCD9C6C317AE5 |
SSDEEP | 1536:RxML9aOZMtYmGvbLcY5YwGZB6zOvtDaXrJ0zCz00qbC5t1DfOmIDaE3/xvZFpxYZ:oL9a2MMLcgYwGWzyXo65HY1/ |
TLSH | T183730701FA16D1B2F3D326F8069B8BA534355C38B853CFD3B6487698A920F485F5673A |
Key | Value |
---|---|
FileName | ./usr/lib/i386-linux-gnu/openbabel/3.1.1/rxnformat.so |
FileSize | 30472 |
MD5 | A9403CBDEEE15E06491FE41FE133B80C |
SHA-1 | 02E59329FB0FEAB761123A86BE29009BB4B11967 |
SHA-256 | F60D386772D2C632AB6B280739715827E6A8D60658AC6CF4091A411580A63EF8 |
SSDEEP | 768:kkr1WNJ89CfvfTRlHC4+oSVscXxGFsQRu/g/Wi6+PG6Y:kkr8NJ89QtKscXxx |
TLSH | T19CD21A81FF92E272DAD315B9010B87F6AA355CB996C785A3710EB75C6721EC4CC123A2 |
Key | Value |
---|---|
FileName | ./usr/lib/i386-linux-gnu/openbabel/3.1.1/maeformat.so |
FileSize | 87916 |
MD5 | D20A1E2E1C397014BB011E1DC6539AF2 |
SHA-1 | 0513A08D6BDA52940AD6BDE1B66C2A4D95A98E5E |
SHA-256 | 395E35D20FCEDC9BF12169A26EF7AB0FBB1766C887D543390AB74B67AA745C13 |
SSDEEP | 1536:SeNZab3PtD5tABvJ76eIsJgwV9dfFtXwEc+zBz8NDPZhAzDAlukQzWHnPqaqxGm4:Bab3PtD5tABvJ76eIsJgwV9dfF1wEc+P |
TLSH | T1BE832A03FBA5CC71F6A385F82247C3BB6D1449659443D5A3B0897F8D68736318E1A3B6 |
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/i386-linux-gnu/openbabel/3.1.1/moldenformat.so |
FileSize | 59264 |
MD5 | 87273B3D89A4B959498BE9FAEEE0ADE7 |
SHA-1 | 074086A062F6672881F3E4C822C548D19653891F |
SHA-256 | 4A658149B748091D37A208470B53D819AD891F212FE9B8924E6863E7659617F3 |
SSDEEP | 768:viN+5UXaex9siDLPBfTRlHCcH5zIBoDhDptC4zWiwr0NmUHKKbrnsuM+xn+EHTAJ:qNCUXaex9siD1tXHbXzWiwo5rTd+Ez4 |
TLSH | T1E443E5437F93F471E6A30AF62107C2F3A9223E74A587C887F545DF983671A84D919B22 |
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/i386-linux-gnu/openbabel/3.1.1/gromos96format.so |
FileSize | 22196 |
MD5 | 476817FFC7068B832EBE2131C1B725D9 |
SHA-1 | 0843E16347510F994DA7C5D3473082DE6F97AA9C |
SHA-256 | C483B658521CD69FDD804871605D9CEB8D3B2CABECD8075BC6B5F44A78BE7174 |
SSDEEP | 384:x2xRJKuFGE5brVcn9/jKBZggTD9/CO9ORLaB7ndA6Gf+UNPtiXSy0:0wVsrVcn9/kfTDcO8RLaFy6tUNw |
TLSH | T15CA2E942BF92D6B6EBE325FA014B42F177361CB6AB8385937459A79C5631E82CC023D4 |
Key | Value |
---|---|
FileName | ./usr/lib/i386-linux-gnu/openbabel/3.1.1/pwscfformat.so |
FileSize | 30444 |
MD5 | 74AFF31A2EFC400C098E6ECC2002CD78 |
SHA-1 | 0C68F259CD235CF47F5499B7760235E2D20D320F |
SHA-256 | 78C0773DFA1F58F59A3871BA373EAB265B4ABB6B84BC79C1C199CCEA3E7AC12C |
SSDEEP | 768:RnSQv1WQ9Kt3fTRlmj1i6HidT4sstnFFAjy3wMOK:RSQvAQ9+tvas/y3 |
TLSH | T17CD208437F52E773E7A76AFA018B42B627390C765A47C997B502EB5C2A32C848D10B70 |
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 |