| Key | Value |
|---|---|
| FileSize | 6248988 |
| MD5 | 9E1A7471BE42EF1AEE0C393F3FCB8D85 |
| PackageDescription | Molecular dynamics sim, binaries for MPICH parallelization GROMACS is a versatile package to perform molecular dynamics, i.e. simulate the Newtonian equations of motion for systems with hundreds to millions of particles. . It is primarily designed for biochemical molecules like proteins and lipids that have a lot of complicated bonded interactions, but since GROMACS is extremely fast at calculating the nonbonded interactions (that usually dominate simulations) many groups are also using it for research on non- biological systems, e.g. polymers. . This package contains only the core simulation engine with parallel support using the MPICH (v3) interface. It is suitable for nodes of a processing cluster, or for multiprocessor machines. |
| PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
| PackageName | gromacs-mpich |
| PackageSection | science |
| PackageVersion | 5.0.2-1 |
| SHA-1 | 42AAEE15E61E032CDA6455CD40C5B8489B3C41E2 |
| SHA-256 | 328240847E92A6A865107705A96FB88B5C6AEC00B779ABBB477924455667B449 |
| hashlookup:children-total | 9 |
| hashlookup:trust | 50 |
The searched file hash includes 9 children files known and seen by metalookup. A sample is included below:
| Key | Value |
|---|---|
| FileName | ./usr/share/lintian/overrides/gromacs-mpich |
| FileSize | 456 |
| MD5 | 2188F2379D276B1226D4A7024DDFA82F |
| SHA-1 | DDC853594626695B0571167E7BB8A7D3A3A3241E |
| SHA-256 | 7FA1C6CD33868E92D3C7955CA2811A3A02FBC7B2D4FE795DD84D44B4BED2BF70 |
| SSDEEP | 12:zHHkrnhL/F1dafkrnhL/FaaOmb9dJWTekrtnhL/F1wkrtnhL/Fz:znk79Fbak79FalmbDcSkh9Fqkh9Fz |
| TLSH | T10CF0A71AE2C89C3BC1AB4F56C6D2AF70A211A1C9D9B1FB98D4C521221D6778219828E9 |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/gromacs-mpich/README.Debian |
| FileSize | 790 |
| MD5 | 641B58DD2EEA54C74BF32637A0517BEF |
| SHA-1 | 49C0F4BA144FAD969E5F5D25D7A6D156D705CE7C |
| SHA-256 | 1B39E3E77357819C9B75B1248DABB2E8BDF780CB3A032464EE537EBD8FA38BD5 |
| SSDEEP | 12:T7U/0+m+YSAVR4+zGQhj6sS7A+LfX/JNL7bh0JXFDKZbCRmF4dbrOfl/bNlAy:T7U/0gARrMJ7AyfH3bh0JXFDuF4fO7 |
| TLSH | T1DE01153D7EC892A01092D895E20D95D8C32E412857AC8180395D761D470047527DFDB2 |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/gromacs/changelog.Debian.gz |
| FileSize | 10441 |
| MD5 | FDF0BEFA7D1D6237B90EAC17EB0776C4 |
| SHA-1 | C3E4160195412E866D0389E16F26929B83B83BB2 |
| SHA-256 | 357A558747AE02D9734C9187FC29E8BB3997910054C306B0DF3D85716A2086B8 |
| SSDEEP | 192:8Pcbu+XriZ7qXkenTyyvRzKJnPT3AugijJGMimvmq9tUY3cu50G/4b5cCkp94QOr:8Pp+7iQkeTyyKJPTv0MiKmq9ZMt1iGQ6 |
| TLSH | T16B22B00A25C39F3B890C53EBBEB159A79A454F1D44ACA5074B46ABE407D1D023730BEB |
| Key | Value |
|---|---|
| FileName | ./usr/bin/mdrun_mpi_d.mpich |
| FileSize | 11015776 |
| MD5 | FB2734615C1BB8B26D0D6BE8235F3655 |
| SHA-1 | 0DA13546CD674E560E846FCABF1A566AAE5D5DEC |
| SHA-256 | BE51D9CE7C527B5154CF7F7ADB8635DE18272C9602B142062619BFFE4289089A |
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| TLSH | T1F3B62840EFF39EF2D3820CF517273434D9282B15449E6DFB9BD4264A9EB5B44AA1E813 |
| Key | Value |
|---|---|
| FileName | ./usr/bin/mdrun_mpi.mpich |
| FileSize | 10552928 |
| MD5 | 514F57E6D8752FAE8A22D3771B8F8476 |
| SHA-1 | 974131472CDFF4C1D5B547FF8949D5C4C053AB4B |
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| TLSH | T13FB61720EFEEAAE0DD930CF1502F5538D0706F074016B5B6FBE12A54AD9ABAC41725DB |
| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi.mpich |
| FileSize | 55 |
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| SHA-256 | 1244EDC6A3A1881F1C41B35FEAEF6EAEACBB0E73B973BA1FCD0AC752BD364181 |
| SSDEEP | 3:OJb1LHL6MTjFHnVKoMGN:mR/6MtVZMa |
| TLSH | T19C90029142D5C46A01D2CD45A1904074C9D0558916D85240906014259C5971294CD5BB |
| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi_d.mpich |
| FileSize | 57 |
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| SSDEEP | 3:OJb1LHL6MTjFHnVna:mR/6MtVa |
| TLSH | T19D90029242D5C46A01D2CD44A1948070CA90554D66D85240906054219C98B1294CD5AA |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/libgromacs1/copyright |
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| Key | Value |
|---|---|
| FileName | ./usr/share/man/man1/mdrun_mpi.mpich.1.gz |
| FileSize | 9240 |
| MD5 | A47E82A9537CDD1B78759CDDEDDA9DA8 |
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| SHA-256 | 32BE1A47591B7FE64D2B24A096C7777B36F340C5BDD27E77264026BDC197CE42 |
| SSDEEP | 192:/0nwQUmzo2Zf/fb7GG4hVMsWmsUBYUXmAq4VSqfHs5AXU:/0wZmzo2VOjXTBYUXmA9sSXU |
| TLSH | T1A912CF250C2B40FA1920CE5A1E2C39D8B4C976DE37085C72F777DE3650E4927C1C9D1A |