Key | Value |
---|---|
FileSize | 3568068 |
MD5 | 04ACB110A324DD1BF233CBD2DE348DFE |
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 | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | libopenbabel6 |
PackageSection | libs |
PackageVersion | 3.0.0+dfsg-3ubuntu3 |
SHA-1 | 54DF64528209A0A678A4DF4CDA8F230A13BC3040 |
SHA-256 | 5FE149334728A17E6BB188F3B3CA6E6ECD3229711B0C3292290D8E0CC991F4D6 |
hashlookup:children-total | 185 |
hashlookup:trust | 50 |
The searched file hash includes 185 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/cssrformat.so |
FileSize | 27304 |
MD5 | 27C31FF2BB00491FF5D37EFFB3F258F3 |
SHA-1 | 025DED970F1E7B2608FED3B48194EA7B475EA8CE |
SHA-256 | 353A152575052DA77F976956424CE41005143A466156C50F292E010AC9601E77 |
SHA-512 | BC67157705A0C858C91856CC618CEB6D7FBF260CDB21DF97CDFBF804E921CBD1FC7EE7F7F76D10A111B16CCD689ACA68E6AB39EA95BE777471C1B96869851572 |
SSDEEP | 768:tDZMVR9aA/nnfXPH/3vnfXPH/3vnfXPH/3vqiaSKC6yNkakakzko0krkDkpkbkML:tD6r9afYIl2uLXrAbJCW/VtvdbwhVJDO |
TLSH | T14BC2A75BEB81AE3DCAD4A03541CB5A71377B5C68F3B0092B2D96932B0D82F445D36F98 |
insert-timestamp | 1662051620.9667876 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/cmlreactformat.so |
FileSize | 105776 |
MD5 | B3DC9CB58092D32C481885F7D5E2F8BA |
SHA-1 | 02D8E7B75BFB8E9DE39D0F86902B0DB277204440 |
SHA-256 | 0340681ADFBA2FD49A06FFCD6AF9C84569CBE8808F0C45D6628C841999B27DD7 |
SHA-512 | DAEA8F312FC68643A623CD1D38A4A4E60B16F747D9B2289F0B3507F6C0BC21944E50DAB3A3FFB7F12D1F560DB78292210F8EE4E22EE0FB702E39AB244EC2850B |
SSDEEP | 3072:ZP1GRqqd2+u8Fk38MUvaSbi4N2uAPa4j6aM4l8Wyadz/:51GRqqd2aFk38MUCSbzNHNj4yWyadz/ |
TLSH | T143A33A0BF98349BCC5D5DA7145CB85A36F32BC7095741B6F0548DA3E0E62F285E3ABA0 |
insert-timestamp | 1662051621.6175497 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/molreport.so |
FileSize | 27296 |
MD5 | 5C69C6DA2F06DE5E1E31062F3E05DB6D |
SHA-1 | 03DE2521B650446F154EDDD97A0B69E0F9F42113 |
SHA-256 | C865E54265BA47DBF485A32DACBD8A7F1EA9B9F833B3F3912C7FD50ED248032D |
SHA-512 | 10446C47B4E655340B98931660846DEA474BC381A9B0613C6B815A966E1DD11FD6FDE396007A0C13A73FAA01392DBCB1028EF42C595C728B69FF519ABD7CF2C1 |
SSDEEP | 768:n5iM9Rz33vnfXPH/3vnfXPH/3vnfXPH/3vqiaSKMk1kLeKDkdFkFkLk5rSB/l9Qs:n5iM9dlrSB/l9QC/M8FYuFS62oh+UjV |
TLSH | T199C2A71BBB00A93DCED85071419B8A7136775C58A7B00D3B395E93AA0F72F84692B79C |
insert-timestamp | 1662051621.7108772 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/fingerprintformat.so |
FileSize | 35584 |
MD5 | E4F5434643A7584B16E9ADEE4291BCEA |
SHA-1 | 05F4E024F957B39013E1A6B5E804B19E6E24BED9 |
SHA-256 | D09D16CE79BBBDD8E2C6494C7847CE415ABB74E3DECDA52156DD8C9211425CB3 |
SHA-512 | 4D1423194AFF561137C5F50A492472D87DF04AB79F3A0D9D3F844973E12E655F73FB43680983CA40DDAC159DB329F2525082E1E9D15BFD61BDA09B90865C26F5 |
SSDEEP | 768:wbVn29o2qXPKC6yqiaSKC6yqiaSKC6yqiaSKC6yqiaSF91tldVNFbYF98kKwPdC9:WVn293F98kKwPdCClil6DXLEdBYx44 |
TLSH | T1DEF2091BFE02897DC9D8D171828F51737B32BC2857B12B2F5B40C72A0A12F94963E798 |
insert-timestamp | 1662051621.8878481 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
CRC32 | 0B300A64 |
FileName | ./usr/share/openbabel/3.0.0/torlib.txt |
FileSize | 9963 |
MD5 | C7BDA1C80C0F535B15BF2B7704CA3F45 |
OpSystemCode | 362 |
ProductCode | 220927 |
RDS:package_id | 315307 |
SHA-1 | 06AD67D93E58B1A00C655B7D8C366DE5A7ECA054 |
SHA-256 | F3B2DF788EF0A7DCA48CF7ED336BD4C3D72055B7EF95294A124A8E37F9791435 |
SHA-512 | DCCC0658CE45B7805E30DD83BE050092E674A82F496D1BA1C7743AC2276CE1D173B4B0A577E11E7FC3ABD9C2647E7E74DBA6B497A31056E89080DE5B9F13F263 |
SSDEEP | 192:yOjk5sCAWJ5oNlte7htKbl2Z71KUU5a7aMDQu1ZRg3g:VkgWJhdtKIMUuu1r |
SpecialCode | |
TLSH | T18622F2347C093B2453EDCAC908366AF14E7CFB9B7E0F6521BD8EA86057987D9C859C06 |
db | nsrl_modern_rds |
insert-timestamp | 1751464366.8990085 |
mimetype | text/plain |
source | modern.db |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/thermoformat.so |
FileSize | 39688 |
MD5 | 1947E3DF08130AD5057CBD6BB7E30A1D |
SHA-1 | 076B9D61002F28198D9AD31A5B7DF40FA3554782 |
SHA-256 | 7E0F44282FB49574F50DEFB2407A1FA13A882173C12F221EDB86A4D88D2D1E0E |
SHA-512 | 95361CAD91A52A3E4CD50EF1B8EDB24BFD8FC02F80735397F580BF4262A866640C8CED63C59635882E82738BC283C8C32EEE0F69C8F5EC0016384F1577CA45D3 |
SSDEEP | 768:uZQySpcePukdLlDHf9swMvyKC6yqiaSKC6yqiaSKC6yqiaSKC6yqiaSF91tldVNj:uSyCUkdLlD/9sDjgtD1hcFZu8Ejyaw5s |
TLSH | T1E903EB0BFA016D7DCED8B47646CB96727662BC685270091F2914D33F0A92F59CE3EB80 |
insert-timestamp | 1662051621.0926547 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
CRC32 | CA76F417 |
FileName | ./usr/share/openbabel/3.0.0/atomtyp.txt |
FileSize | 10155 |
MD5 | 60C777DDCDDF90D0269AAF0263EDFE14 |
OpSystemCode | 362 |
ProductCode | 220927 |
RDS:package_id | 315307 |
SHA-1 | 082678951146C04915BF5201E55D22AFEBCC1E50 |
SHA-256 | 78E52637266CA914232A64F4979B03E0BC8BE0A91B7036EC38039F2876BE080A |
SHA-512 | D01C14BF240B05E455F28BC6CCBB265A25DE0F744418459800842C234C33D530CD6DED78E969866F7CDCDEC0817A0ADF2CE179D91CA7DB892B3FEC4FBB79A61F |
SSDEEP | 96:pc7oCWkdbttazfi6UzFNWiR+/zQX0OsjruaPyOM8RXfl9QGBCpv16uJVCXOwCdS6:CLNGzqvpNf2zES7DMel8tg9L+J/ |
SpecialCode | |
TLSH | T12522BD50685AB34E2337968BD51BD58451B8D72A8EEB049C382FC941837093BEFDD62F |
db | nsrl_modern_rds |
insert-timestamp | 1751464366.9276748 |
mimetype | text/plain |
source | modern.db |
tar:gname | root |
tar:uname | root |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/painterformat.so |
FileSize | 39616 |
MD5 | 2FF8145EA6D01ACE785C04E0BF1645E6 |
SHA-1 | 083A653183608BC54866B626D161797DC2A067B9 |
SHA-256 | F8C3419E2BD0E18C4D5EAE21E3F38663E562BD874F1CE80D99526DDA25FBDAA4 |
SHA-512 | 98976F6743C23D50F23059BCDA3C6B8D790D189F180D19A1F0CCBC5777CC4AE55AC1FC8E752290CFEA22722411409008A4DAF77A46B2CD64721BE2AA4C23566D |
SSDEEP | 768:ebtQM9E/w6XPH/3vnfXPH/3vnfXPKC6yqiaSKC6yqiaSKAqfy9uklQ7leEDQQtwU:ebtQM9ETqGuklQ7leEDQQtwFLXC75Ba8 |
TLSH | T1FC03F90BFA419C7DCFC8C835824B967176B7AC68B3F0092B2945D35D0E92B95CB6BB40 |
insert-timestamp | 1662051621.9638913 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/chemtoolformat.so |
FileSize | 27248 |
MD5 | 3538E39FB33D2003106A4018C9185BBF |
SHA-1 | 0AA643F4868C9BAF7353380A95C92229EAFD8A64 |
SHA-256 | CE546553FEC2E62FA50D072AA577F504260DC5C1002287588BCD51B92F71AE01 |
SHA-512 | 1A14776BF0041E62086FE9CCEA4523CB01563C14B6C7C6018BF39F1C09CBA22D0F2C1B1B54642DF451160A2B8068D4EF9D91D8D06FFE6B442435245E8798599E |
SSDEEP | 768:ebLr5S9SrXUsEc0MnfXPH/3vnfXPH/3vnfX4xk96koU+9XLMWnXkxL61eqxEztKe:ebxS9f5U+9XLMWnXkxL61eqSztKsFXx |
TLSH | T156C2E95AFF80AD7DCAD45435418B5671327B9CACA3B40D3B1E51832A0E66F448D27BA4 |
insert-timestamp | 1662051621.54783 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |
Key | Value |
---|---|
FileName | ./usr/lib/openbabel/3.0.0/rinchiformat.so |
FileSize | 39728 |
MD5 | 7BBC381D649DDED0C8510B1B06B5588D |
SHA-1 | 0AFC44623CEF4F943DD3F55C888094AC1E0F79AC |
SHA-256 | 49295B17B72FFA4E6D3B9E9283982E43BE60CAD617738AB90F7D3C923CC3B431 |
SHA-512 | B50F151D570911E8D26E94096FE5E91528D7BB0CCCE507A2D01CCE3CB8BFF120F854239B283698984B964816F9C035EB344CBB73B3A1A9863E09D97333A07018 |
SSDEEP | 768:dxzG9Pi6yqiaSKC6yqiaSKC6yqiaSF91tldVNF91tldVNF91tldVNF91/8fVIkvP:dxzG9PVIkvuLYcg7Yr2f1+kdnbBQVV5y |
TLSH | T1EE03090BB6525D3CCAD9D475434B56627673BC68A270193F0E48E32E1FD2F68897E390 |
insert-timestamp | 1662051621.769759 |
mimetype | application/x-sharedlib |
source | snap:e24ZnOQOwOOS0gcGPsbGMxySRAk2oR8Y_60 |