| Key | Value |
|---|---|
| FileSize | 7883896 |
| MD5 | 89FA96F070F1F077FC18F49FF6DDC91A |
| PackageDescription | Molecular Graphics and Modelling System Avogadro is a molecular graphics and modelling system targeted at molecules and biomolecules. It can visualize properties like molecular orbitals or electrostatic potentials and features an intuitive molecular builder. . Features include: * Molecular modeller with automatic force-field based geometry optimization * Molecular Mechanics including constraints and conformer searches * Visualization of molecular orbitals and general isosurfaces * Visualization of vibrations and plotting of vibrational spectra * Support for crystallographic unit cells * Input generation for the Gaussian, GAMESS and MOLPRO quantum chemistry packages * Flexible plugin architecture and Python scripting . File formats Avogadro can read include PDB, XYZ, CML, CIF, Molden, as well as Gaussian, GAMESS and MOLPRO output. |
| PackageMaintainer | Ubuntu Developers <ubuntu-devel-discuss@lists.ubuntu.com> |
| PackageName | avogadro |
| PackageSection | science |
| PackageVersion | 1.1.1-0ubuntu5 |
| SHA-1 | 0FF38A9FEA521B8298E7B1E49BDE386DD1CFE833 |
| SHA-256 | 681377AF6E1D2565826E63E673386FFDA7DE86234DBCFCD272E4E7B695DAA394 |
| hashlookup:children-total | 172 |
| hashlookup:trust | 50 |
The searched file hash includes 172 children files known and seen by metalookup. A sample is included below:
| Key | Value |
|---|---|
| FileName | ./usr/bin/avogadro |
| FileSize | 727184 |
| MD5 | 84A14FC16B7EA2A39643DD028BCE6433 |
| SHA-1 | 009240726900856747844B149A27636A9136C72F |
| SHA-256 | 04739255EDB51EA3D85B6F7B85C1637BF76529A4EA99019F4A93AA6E41C33D2C |
| SSDEEP | 12288:5Zs4HteixQ6aihw8xjE4n+TfKWOc31SIHxHfLPeoqf:7Tii1E4n+TfKWhSIxfL9qf |
| TLSH | T1CFF46B123B1D5B93C3973E7625FF06C6C35DA6CA4031F289121F129F98A9E66017BBE4 |
| Key | Value |
|---|---|
| CRC32 | 0D542026 |
| FileName | ./usr/share/avogadro/i18n/avogadro_sq.qm |
| FileSize | 12522 |
| MD5 | 56048F2F3EF0FD35E9134E28377953C0 |
| OpSystemCode | 362 |
| ProductCode | 181156 |
| SHA-1 | 0164129F6682F4445BD570513CF954465D1E27A7 |
| SHA-256 | 2477BFBC9F44825CA8D13D8CE16A6B773DBB28BFF8C63B3FDA440DF2165352A2 |
| SSDEEP | 192:+Wxkk/snc4nrIkqkR4JItgUhfr+7PdBFBxDeUYz:Tx56kkqkR4shfrgrFBxUz |
| SpecialCode | |
| TLSH | T1B342878221F4AAEEF6F7193C4AAB434DF31770363630921F9255F2245C54085BEB77AA |
| db | nsrl_modern_rds |
| insert-timestamp | 1646978373.8488364 |
| source | NSRL |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/python-avogadro/copyright |
| FileSize | 8218 |
| MD5 | 8E06DF6FD0311199EF2E7D1157227E7F |
| RDS:package_id | 182052 |
| SHA-1 | 020D5B5B0A5E91C31C1EBDCB415F143D2DEC0BD7 |
| SHA-256 | A903C5BB69E99C29F6D0849983CC3225F1196F03CC30227927CC8EA91FC6A1F7 |
| SSDEEP | 192:lH9IjCz5z8oYWzQjYrsgrs+rTV37cwrrsRrsUMT3zTaBjU:bIjCzF8oYCQsrsgrso979rsRrsUMrHL |
| TLSH | T12402E80B121C4FFBE89AC183FE8699CCE39B9658751F680234FDE24C531B71E22B05A4 |
| insert-timestamp | 1679427281.6054657 |
| source | RDS.db |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/avogadro/examples/methane.out.gz |
| FileSize | 5584 |
| MD5 | 8080A50C4C0A95DEB38B4563D9BE82ED |
| RDS:package_id | 182052 |
| SHA-1 | 04609728BAC62CF04F5E35502C0DD3ADDD0B9C49 |
| SHA-256 | 5483103F6E128476FFCB09D29C4F39422E2CF1F5532430B52DD7EC7ED61A4E7D |
| SSDEEP | 96:KFOz1bfMNC9EXOY6m9hqkfbtrW2F3XhQT0zOLQt8oiCj9vOwbEa7Lv:yY1bOCLYJPhrW2FHhW0zidCBvOwoGL |
| TLSH | T1E1B15FB64B56453DA28F58BF43F376B69647752F983B2020404B0F8F2BB58186CDEE06 |
| insert-timestamp | 1679427281.2504258 |
| source | RDS.db |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/avogadro/examples/methane.FChk.gz |
| FileSize | 4616 |
| MD5 | D214E44EC06F5A92C524A8C9F1BBBD4D |
| RDS:package_id | 182052 |
| SHA-1 | 06057AC2BC3F906077825AAEC2DC050FCE777080 |
| SHA-256 | E31970AC1E16B2E0C45ABF758B65A2DB5C83EC9C28FB5FEE8344F4528E933970 |
| SSDEEP | 96:0uK4Z9Eu/2eiJqWsQU3O2TqL6X7NSCfP+CV8uPN:u4Z9t2dpUBeL6JTP+Wl |
| TLSH | T1A8916C90DA756830870B73806298774F6E83110EC16856F489F0642A7E35C7F76EB87F |
| insert-timestamp | 1679427281.240543 |
| source | RDS.db |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/avogadro/examples/methanol.nwo.gz |
| FileSize | 25499 |
| MD5 | 7053757DA61A61811C9DB2CC8F77D07C |
| RDS:package_id | 182052 |
| SHA-1 | 06583D39E07179B25BF2444C9F8E7D18F4C8392D |
| SHA-256 | AF9A2D14D1DF3E4E67860C246527A96935B5583E0D3F4A7D672AB1AC5EA610C9 |
| SSDEEP | 768:ABM020o8VEJLditdmtSrvisE7ymGq1UTghGc:2M0dxVEWtUQbzq1kghD |
| TLSH | T127B2D11171E99F037CF514AC1A2DA8967254BFC81E13F6210B358171BFDF46162A8C6A |
| insert-timestamp | 1679427281.1238441 |
| source | RDS.db |
| Key | Value |
|---|---|
| CRC32 | 23242281 |
| FileName | ./usr/share/doc/avogadro/examples/basic5.drawlog |
| FileSize | 2387 |
| MD5 | 2C0A053C5E6407421E6D61A6B0F2EF51 |
| OpSystemCode | 362 |
| ProductCode | 15084 |
| RDS:package_id | 182052 |
| SHA-1 | 0E68E0EB38D729F7BF59BEAD767C09FAE360CD1C |
| SHA-256 | BD746D3081C6DD885E2255BEC29BEB88E00F300CC92318A7986EDBD8EF615490 |
| SSDEEP | 24:IPwPHWMVZ3fhXbJsFeysFeBsFekjlsFeRTsFet4yA4e4+P454T1dLqTfXQUfiIfn:I4fWMXpJovejln32nPGI1Zqg1fu |
| SpecialCode | |
| TLSH | T180412B4E85F85843C749A4F38862ECC5438063409BDA722B7B7C67A079B48B49FBDED5 |
| db | nsrl_modern_rds |
| insert-timestamp | 1679427281.5836737 |
| source | RDS.db |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/avogadro/examples/VASP-DOS/POTCAR.gz |
| FileSize | 63148 |
| MD5 | 281F9F48437593E8A8ADD968689BD3D2 |
| RDS:package_id | 182052 |
| SHA-1 | 0ED1F9552855F4D2A6A78F0FF2845790E5B7DFE7 |
| SHA-256 | 0E518B2DC604C1ED11D0B5A78C26509365CB2DFC0D41709B3FA3815700B829C6 |
| SSDEEP | 1536:z7gN7tmZUJmJwGlIOeA3UEy6uRalIrNKo5CcriN9:XgNIZWLOnGoIrnU |
| TLSH | T14D53026A2E5A61C935DB2354B34E988CA4F4BC16F3C4DE947FE4449EFD12032E5F901A |
| insert-timestamp | 1679427281.5116856 |
| source | RDS.db |
| Key | Value |
|---|---|
| CRC32 | 384350CD |
| FileName | ./usr/share/avogadro/i18n/avogadro_ca@valencia.qm |
| FileSize | 23813 |
| MD5 | 4B7669BE9E5C90BA0D4269B854170F79 |
| OpSystemCode | 362 |
| ProductCode | 181156 |
| SHA-1 | 10353B81FA67AD361BC3F646664F34E8A895CFBE |
| SHA-256 | 7EF238C23067B88ED3F68BAFE37F1B0F4CC1AED12D0F3F6F125B158216FEB719 |
| SSDEEP | 384:JxZN83fOjCwAZ7lzFqsEml6ojx9HEutjuPQNKkUqnsHd9dxEQG:JxQfOjhs7l5qsEml62x9HEuqPQNKVqn5 |
| SpecialCode | |
| TLSH | T122B2044132F49AA9F6F70E7C6A77064DAB3B74662A34D10F4221E1281C64944BE73B7B |
| db | nsrl_modern_rds |
| insert-timestamp | 1646983779.1871648 |
| source | NSRL |
| Key | Value |
|---|---|
| CRC32 | A5FD5CDF |
| FileName | ./usr/share/avogadro/i18n/libavogadro_vi.qm |
| FileSize | 162119 |
| MD5 | 3E7F845C1F19AD0CFC8EC5B703039F1C |
| OpSystemCode | 362 |
| ProductCode | 181156 |
| SHA-1 | 113F966C3DA5ABF8F9B4647EEF16F5AE06FE685E |
| SHA-256 | 3B7B220DB283D23AFB7ECF874835C2982E7A5E3703457BD4848227A2B1189830 |
| SSDEEP | 3072:zJS/3USVTnaA+bAPEJAXrP0pNC8VzmYKdl2K2kOjmCw:zYktS |
| SpecialCode | |
| TLSH | T1D5F36265D2FF64CEF5F6463C5743024D6B76A8D190B2D71BA36BF1290104848AFAEB32 |
| db | nsrl_modern_rds |
| insert-timestamp | 1646984234.0882916 |
| source | NSRL |