Result for 25928A40CFAD2D9FCF42B3345860670DACC75439

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Graph view
Children (45)

Query result

Key Value
FileSize120344
MD526BB43584FC986B5D365D322313C70EA
PackageDescriptionChemical toolbox utilities (cli) 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 includes the following utilities: * babel: Convert between various chemical file formats * obenergy: Calculate the energy for a molecule * obminimize: Optimize the geometry, minimize the energy for a molecule * obgrep: Molecular search program using SMARTS pattern * obgen: Generate 3D coordinates for a molecule * obprop: Print standard molecular properties * obfit: Superimpose two molecules based on a pattern * obrotamer: Generate conformer/rotamer coordinates * obconformer: Generate low-energy conformers * obchiral: Print molecular chirality information * obrotate: Rotate dihedral angle of molecules in batch mode * obprobe: Create electrostatic probe grid
PackageMaintainerDebichem Team <debichem-devel@lists.alioth.debian.org>
PackageNameopenbabel
PackageSectionscience
PackageVersion2.4.1+dfsg-3
SHA-125928A40CFAD2D9FCF42B3345860670DACC75439
SHA-25667A63767AAF228ECFCA5E4E9981B4F829A025B03BA975AFDB8DF8F2F802D9D58
hashlookup:children-total45
hashlookup:trust50

Network graph view

Children (Total: 45)

The searched file hash includes 45 children files known and seen by metalookup. A sample is included below:

Key Value
FileName./usr/bin/obtautomer
FileSize14784
MD57D870B9B6DF34315608F038626DA96EB
SHA-103357646CFEE62168645E256667832443D1C9B18
SHA-25635BDB79370FA53FAC452FFFAA8F9CA74E5C52EBC58FD0AC50E2BCF37E3F8515E
SSDEEP96:w7gx2UTm/D8cB+BpHqtaSHTACi4m3Zj0ugrSnmwHwy/WYo600Asop7QUTqMsRRyK:wWeD3w3Hg7zACKwJyrui8LqxeoqGpNS
TLSHT18C62A54AFE49DD3FCDC09775888F4778B3125848E78A43C7620E82157F427AE9E1A65C
Key Value
FileName./usr/bin/obconformer
FileSize14712
MD593956C547BEFCC2CC299A93576B0B71E
SHA-105AD70E900506BABF6249A45780A529DF7FF9C9D
SHA-2566FA8FD943F9744B48BAD0BA3D8243A945675207526F0584AE80AD7266E1FC5D4
SSDEEP192:pFwymwTTfyAlNNvticVkP15PiBhkF8S36:syLfyAPXfkLwM
TLSHT17E628386FE45AF3FDED4573595CF47B073324C8CE38A43C7A11A86142F4275A5E29688
Key Value
FileName./usr/bin/obsym
FileSize14728
MD5C85F5E3C749DD44F27D0744FB3D504E2
SHA-110B056FAF318821FEA243D3AD224CB69B73AED00
SHA-25677030FBEBBE706321E647BEEF9DA9867E8E0BF2227310925084552804ECEF9E0
SSDEEP96:y7e4b1B+BqdevqTAwifErr7AVVdVM5dC3Rfzu0SvuCx93r3hSgr7lcSL:ya4xwUdeuAwKErohV6MSvuCx9rhSs
TLSHT1BB624E85FF46E93FC9C46BB1448B567077339C88E78E5387660986242F42BDE6E25288
Key Value
CRC3279F0EE23
FileName./usr/share/man/man1/babel.1.gz
FileSize3694
MD50F03EEB2A2D7493B119F12E4F1C7083B
OpSystemCode362
ProductCode181156
SHA-1154290B1891EF2463CB27BAED0C4F9244FAA22EB
SHA-2568233E26437D3A7E513AA66C5773350587ADDC55937B898165D880D280E89CDFC
SSDEEP96:21Bcf+ITZpzYiPgk4w1OXGN00x9t8RqHyCqqvTWA:21BcmIlxvwWNr8MHxWA
SpecialCode
TLSHT1FC716D35E16CAEB02F88A34CAB0F2C0DAD36C080605777EF9984179F5D1CB484676926
dbnsrl_modern_rds
insert-timestamp1646985968.228033
sourceNSRL
Key Value
FileName./usr/share/doc/python-openbabel/copyright
FileSize29241
MD51B9597AB960B71F33AA7CBF07E2E964F
SHA-1241BC079714911629122DBDD37B390048D25AD43
SHA-2565B3D02092B74BF02F43C3F46F7D946E702D8F58ABF2E67928CA006BD1EB317BA
SSDEEP768:EBgdvh/FHb3HlMNoMN4tSQuMSth0T8aahxsXuGb6cEcrb4vI:0gdvh/TbbIDNosA
TLSHT169D2A52F7B4543B22AD11291364F50DEE32BA16C327B4990709DC19D236BD3253FBAE9
Key Value
FileName./usr/bin/obrotate
FileSize18872
MD560462728B058A308CDBB56F64A2FB30F
SHA-1278DFC70AE719D89B378AFEA45AD0D3C68B77FE5
SHA-2564FA7C973C53BFF8C0C216F7EE89E1BF49F9D151EB2E3135CD503C8EF6A24D81E
SSDEEP192:wQwT3YrBw9ukAW+WwrjU3H1hOoJ3deK38UYF1bb5NKR/RS:b+YrWukAWNwMlx38FTXK
TLSHT14F82D519FB48DD3FDDD26BB8009B137CB3A29854E3684387520886502F8BBAF0D166E4
Key Value
FileName./usr/bin/obgen
FileSize18960
MD5546962F0867C5A5C4FD7ADB26A0409C2
SHA-13DE15F9B4E651C6A1FA0382BE48A4511720CF73D
SHA-2569144AE5059082F9AD44C5E8720027BF411C8E52EC31BAF32226D479A8F1C12AC
SSDEEP192:VKskrwZTzAYRqCfIjVB9x6gjwfhs4/lbXHW0y+vS:Q3WzAYDfaDxtjwfhv/lbXW0y+
TLSHT1CB827382FA46AE7FDDD16BF5148B0674B3B38CA897B883E7710985145F83B5B0D35288
Key Value
FileName./usr/share/man/man1/obsym.1.gz
FileSize806
MD53F72861AF58D802DE95B715EA00F7C98
SHA-1485E1A13B7BB0FF89504793BF1B287D5380CA871
SHA-256BC3525C46466F08A6862A4A06C45152FB7867419326B59026DB1AB3569814E9C
SSDEEP12:X7z/d4/qUTOirkJ4N3S/olu0ERrHQ6XQVoDfuOSu7OPr/QGLWTm5AKfdY2o71TVF:XA8Ju3kHRIoDuOSu7O1iTOAKlY2Q7H
TLSHT17A01CA7853AC1DA5C0D61E3798F05761FE67C4BB5998C038E4241818605C5E59FC9137
Key Value
CRC32F1C1A70F
FileName./usr/share/man/man1/obfit.1.gz
FileSize1236
MD56C5777667F3CAE1F2DE7DA2CA20E333D
OpSystemCode362
ProductCode181156
SHA-14F7ED09CEF007309916B657AF39491143C52CBFA
SHA-25694E9C7D383190222A89990A872CE3D82E24BDDE8024E1FC546AE14DE59C3E2C4
SSDEEP24:XhbbHpdqfVp64WMsxS6s6900EsbfUP1Xfk7AZiMdEk/Uu7NvjimHnLwq19rHGV2X:XhbbJ4KMcSA900xUtfGaOANXke1dX
SpecialCode
TLSHT15821EA65D89CE2D959F6DE315082358F2D0EB1FCCDCD057AD1CA5329961048105DFF5C
dbnsrl_modern_rds
insert-timestamp1647007820.0786736
sourceNSRL
Key Value
FileName./usr/bin/babel
FileSize27160
MD5992E91B7DBCCA879403AE34BDD8B9450
SHA-153F78FE6855A31F8FAC08E1384D37E5DA7F353B6
SHA-256DC12F5EBB3438A5ADEF46E4466AAC7D9134E4C82282B9E1D1F5BC8DC89352693
SSDEEP384:XnpecAYwg4bQwhqcBv1gwkmthVm/5uWmA0WhYT9FdVNxvBUlqG:XVcndgvSmIWT0/VVbvut
TLSHT1F2C2C696FB1EA837D8D3EBB914C71764B7636D4497128693313DC00D2B4AFACAD246C1





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