Key | Value |
---|---|
FileSize | 124756 |
MD5 | 7CFF8EC524CFBFD1BB0D2732AAA1B295 |
PackageDescription | Chemical toolbox library (development files) Open Babel is a chemical toolbox designed to speak the many languages of chemical data. It allows 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 static library and the header files. |
PackageMaintainer | Ubuntu Core Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
PackageName | libopenbabel-dev |
PackageSection | libdevel |
PackageVersion | 2.2.0-2ubuntu3 |
SHA-1 | 3A509916B227AEBD9AF98E75126D12655F1398B1 |
SHA-256 | F6AA7EAE4BF4935FE55B727F2262F0BDF1CBA81D15819860A733F52F9D73D439 |
hashlookup:children-total | 58 |
hashlookup:trust | 50 |
The searched file hash includes 58 children files known and seen by metalookup. A sample is included below:
Key | Value |
---|---|
CRC32 | 867E6651 |
FileName | rotor.h |
FileSize | 16334 |
MD5 | 31783D3E6A38661C7F8982C36FD3755A |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 02A27178C16BBE2A8316264586DF79FF03327B0E |
SHA-256 | E098B10E8376C27DA584CC55A8E9F92AC5AA307F206686F524E629365F981760 |
SSDEEP | 384:CafUPuWzOhXYjdkNFthteJRH2RyVRXtByvWDZh4Vum5mg8ap+g6GwrkncWmdbI4:CauuMOhgyrtht6RH2R0RXtByvWDZh4kp |
SpecialCode | |
TLSH | T10272A64EB4D3AD120A139238974A61D0A318C0E7E2C8EE25764F63247FD66354FFD57A |
db | nsrl_legacy |
insert-timestamp | 1648506994.1634147 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 591A4D11 |
FileName | groupcontrib.h |
FileSize | 2983 |
MD5 | 35CF7F843E8E513F152AA30A1D47A7DC |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 074FCA0059FB3C8AFE9849F27E1598E25F702664 |
SHA-256 | 40BACEDEDAE002665BA707603EFD5CCFF30136FF43F60A3E6E88037F659C117E |
SSDEEP | 48:dFJUSTXSpcDiyZH1il3l1mWvrdiGv+ZkxV1G757+bMHXH2mVG0OXYH/Sg:l/TXSpa31ilV1mordopuuHprtx |
SpecialCode | |
TLSH | T14651871CE8708F61CEC211D647C785CAE306D383F2689863758EB5101FCDA69E9F369A |
db | nsrl_legacy |
insert-timestamp | 1648506994.6171734 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 3B87A7A4 |
FileName | fingerprint.h |
FileSize | 7096 |
MD5 | A586AF3B8947726F7CB442C49B3EA5E4 |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 09A42D45BCFDD7B110E79C3FC095C41FE3544B5A |
SHA-256 | F58F031F8FF212628A193471904A0111C3FF05BF9A2B23EBF512C4E7EC60B6B8 |
SSDEEP | 192:Upa3jg1D1x1uWQ9aH4uGx9fGwRUUIQpyaYN9bBRAOb4tr:Uas1D1x1uWQgH4fxcica21BRAOb4J |
SpecialCode | |
TLSH | T16DE144992470AC32642701D6C3862AC6951E846EF7E4ED30715F712C3F8E854ABFE7D6 |
db | nsrl_legacy |
insert-timestamp | 1648506995.5323317 |
source | RDS_2022.03.1_legacy.db |
Key | Value |
---|---|
CRC32 | 6F85DA97 |
FileName | oberror.h |
FileSize | 8999 |
MD5 | 6572F37C074A44D52592BBD415894BE5 |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 09CE3F021A09DFC74AF0B1F10E0A6AE78BC7C724 |
SHA-256 | 47FC0C58B6951C8851BC88195225A2D60F0B05F97EA76413417635C5D5BD9A6B |
SSDEEP | 192:ZIpa/5cU7cY2Y8u0h7fCjm2wkzb65a3jo5fkyFieTHZxdPJ/CtBpCcXCX4/HYV99:ei5cU4Y2Ru0h7fwyCb6MTqfkyFdTHZLz |
SpecialCode | |
TLSH | T176025316EDF2AE2A56230156B386B0C692781443A324F5C0F6DF73792FCE5618E713A4 |
db | nsrl_legacy |
insert-timestamp | 1648506995.0917652 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 482FC204 |
FileName | matrix.h |
FileSize | 2498 |
MD5 | D42BC7BCBC8551AA7E6E0DCBB40963BC |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 0AB1D6ED056AA1F1B873AC6D64A2813889C9621C |
SHA-256 | 1473E6E65FFCB3003C1D666843A3E73371B9680597F2BBD1F466483C75CEFF73 |
SSDEEP | 48:AOac1SpcDiyZHoVe8Gte8Rx+sR7RhRl+Rf7Rs+7RZpuRZw+xRJIRJQfeQ:0ASpa3ie8GtBRx+sR7RhRl+Rf7Rs+7R8 |
SpecialCode | |
TLSH | T17851694E44542E7BAE9212D5A5D22AC0EB0185C6A38DF50C740FF0616F9D162AFBDB2B |
db | nsrl_legacy |
insert-timestamp | 1648506995.3047926 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 5D2B1B43 |
FileName | dlhandler.h |
FileSize | 3437 |
MD5 | 438F01DF78234B6F5500A6B8C0ADC855 |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 0DBB16E55ABB245AC4CB273D26FF65FDC757B2F0 |
SHA-256 | FDB99B74C73A9C1867C39E89932AA8F7C2A70C703169E09935D6768880F3A1CC |
SSDEEP | 48:tS/cp/iyZHs3nmekHxkBPFFxfBAnyMPXjCmiKmgqrWxoAwhQScbnMGjgiOKQOI:tS/q3sXRpPrAHjCffWKAsTcL/jb/vI |
SpecialCode | |
TLSH | T1BB61B725BCADEDB2D94606A1238C11E1EB0ED5FF136415A690EEF2403A0D4751BF92E0 |
db | nsrl_legacy |
insert-timestamp | 1648506993.537574 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 98584C65 |
FileName | kinetics.h |
FileSize | 4843 |
MD5 | F6AFD6062A7544EA49DD59B139643B26 |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 18964627B7CEE86CC603267085252BA8A66D2C8B |
SHA-256 | 487EC899C39228FA6867DA62B57A4EF414FB10E81161D2A700904A172984C045 |
SSDEEP | 96:6Spa3iuNQOFdbgiu/gEq316l2LOqRq9lzaV+e/z1S:ppa3iuKcEiu/gEql6l2iqobzag+S |
SpecialCode | |
TLSH | T181A1858D7A58BF61464381E4428746D1B236E4C5229CC845749FB0242F0F969B7FEB7B |
db | nsrl_legacy |
insert-timestamp | 1648506994.3164814 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 15DB25AB |
FileName | alias.h |
FileSize | 2830 |
MD5 | 191455B9FD3773B190BDCD50C6AE1D52 |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 193F8694AC27EDE9FB0707930D31C1CA43A4786B |
SHA-256 | 38A04BBB5BB5663205CCB611DC147FF6762E625A6A92562B5B92F138075C038C |
SSDEEP | 48:ddRDcDiyZHVlv9U+gVt8EhAflZhHQKCF/vCtkmHwBcpkzuomWYmotn:Na3z+tv89flZ1Q/F/vpmQBcpwuomWYH |
SpecialCode | |
TLSH | T1FF51427A7961CFB9400611E2B14E82D1D21D88A1F3D88E90514EF22D760E8DDB7BE9ED |
db | nsrl_legacy |
insert-timestamp | 1648506993.831543 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 928C1D76 |
FileName | xml.h |
FileSize | 7927 |
MD5 | 5888C53A033492642A47EE55F185D43B |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 1BEAF30A8AB4DF7852E6D9589C61FCDA274AF549 |
SHA-256 | 6C09C598C583724A083B3D9C4E17B457D865C881656B6B6533FA68BEFDF1ABCE |
SSDEEP | 192:1a3unGJ1HfCSaUa3PSmpfqAMkhHZZClETp/FY:WunO1HfCSajfSmYAMkhHn6ETp/FY |
SpecialCode | |
TLSH | T11FF1420A66C2FC3B864344E783CA74D1E315D42376D4DD11B5AEB2481F8CD589AB77C8 |
db | nsrl_legacy |
insert-timestamp | 1648506993.9901023 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |
Key | Value |
---|---|
CRC32 | 1C099AFA |
FileName | parsmart.h |
FileSize | 9078 |
MD5 | 5C9CF29661E84D12529800817640CD82 |
OpSystemCode | 362 |
ProductCode | 9735 |
RDS:package_id | 9735 |
SHA-1 | 20C479596371C25CD1AFD3077A90C8C1194D9643 |
SHA-256 | D6388FE8F5D6136C49E338BD5D134C9E3E23A3E707367FCBFDE622FB771C493C |
SSDEEP | 192:YLpa3lfzLbpinXL62XCe/R8RXAeVBd+/BuupHKoAgGR18RnznRnbRk3RLY:malzIXzCi8RQEzcMQHXAgGRqRbRbRk32 |
SpecialCode | |
TLSH | T13B126299F6E2DE60446204B98B8EA1C0E345C0A7B7C5D945B84F73301F6F2369FB51A8 |
db | nsrl_legacy |
insert-timestamp | 1648506993.4500568 |
source | RDS_2022.03.1_legacy.db |
tar:gname | bin |
tar:uname | root |