| Key | Value |
|---|---|
| FileSize | 3356464 |
| MD5 | 40613E5FAAE1BC35ED20427756331873 |
| 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 | 2020.6-2 |
| SHA-1 | 5B7576D6E08BC9EC12CC9F2E3B9A87AAF7932DCE |
| SHA-256 | 863D1CF5D6328BAF91648CFF209AF17CF6EDDFA641CAE609DF5C2276DF3889C2 |
| 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/bin/mdrun_mpi_d.mpich |
| FileSize | 6690480 |
| MD5 | ABC7305D1C8F10FC777F0B1823FBA854 |
| SHA-1 | 2BA0FE47634CAC33086363C669CB30D867517EA7 |
| SHA-256 | 95E9D87C1AC8E23F82F01DB6C5286AEC9EC2864DD3ADE7C9252F87AFD05484C3 |
| SSDEEP | 49152:Z46tmMfZbxLkMcbatu6Zh5ojpLSlDn5Zwr1P9Oj0WHiNcewyUPXAmv5uQ9Snrbvp:Z4+m8Zeva/ZDoId5Zwr1Pcj0WqRbs |
| TLSH | T166666C97D8E1C78AC0B86D33D2A66FF79653357519E56E0C8EACCB3218A0220931DD77 |
| Key | Value |
|---|---|
| FileName | ./usr/share/man/man1/mdrun_mpi.mpich.1.gz |
| FileSize | 5702 |
| MD5 | 2FC799EA728186E33FBDEE9AC2C4C63B |
| SHA-1 | E6D07DE68B6526487CCA112D8AFD6CEC8D516C30 |
| SHA-256 | E288A4BFD205E255C40997022F6FA05CA175142D84499873DF0837ED5CD4C655 |
| SSDEEP | 96:dmqd1HJEPo+e1TN42bPxWHoqtA6VcZC15cbqEmJ3yCr4sL9NwvU8idE/MidxlxzB:Z5+4TN42jvp6OU1OmEmZyCfBQuEU4lx3 |
| TLSH | T12CC1AF4CDACC8674ADADF2B6F12EA30580573381C0D975D879B48FF9A400DEB4067136 |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/gromacs-mpich/README.Debian |
| FileSize | 792 |
| MD5 | 592DA9605F3406B4594806E1374AE5AE |
| SHA-1 | FFDD4B0A6DD044A1E4604316A1E528F6FDA7AB8F |
| SHA-256 | 5680557E5C0D86C0707C6155472AB1AD63B58537810DFA03239E6E0EE8BE6218 |
| SSDEEP | 12:T7S/0+m+YSAVR4+zGQhj6n0S7A+LfX/Jt7bh0JXFDKZbCRmF4dbrOfl/bNlAy:T7S/0gARrM0S7AyfDbh0JXFDuF4fO7 |
| TLSH | T18201103D7EC892A01092D986E20C96D8C32D86286BBC8180389EB61D4B0047627DFDB6 |
| Key | Value |
|---|---|
| FileName | ./usr/bin/mdrun_mpi.mpich |
| FileSize | 6604464 |
| MD5 | D94443A4100482ED4F9219165BAA2FF2 |
| SHA-1 | DBD7890BDFAADBAC8AAEE7F193ECF5B26BE34155 |
| SHA-256 | F31E6190892B79A9A35DDF7E925DB1E154996E97254D354E3C8D7CB8587D0684 |
| SSDEEP | 49152:PKG70571PXSm8oG8GW0kq6hkvJVD3DAfW03H4hivS+cpctTYFgYyyGAFDMuQ9SnH:Px057lSm8D8FZhCDAfTIhi7cpctCdPY |
| TLSH | T137666CD799B1C78AC0B86D33D39AAFF7825336351DD6A90C996CD7322C603248719E72 |
| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi.mpich |
| FileSize | 55 |
| MD5 | DD95B912646150567E172D650DFD3C25 |
| SHA-1 | 44AB60513C9559BC90F6013561514140750F27C7 |
| SHA-256 | 1244EDC6A3A1881F1C41B35FEAEF6EAEACBB0E73B973BA1FCD0AC752BD364181 |
| SSDEEP | 3:OJb1LHL6MTjFHnVKoMGN:mR/6MtVZMa |
| TLSH | T19C90029142D5C46A01D2CD45A1904074C9D0558916D85240906014259C5971294CD5BB |
| Key | Value |
|---|---|
| FileName | ./usr/share/lintian/overrides/gromacs-mpich |
| FileSize | 417 |
| MD5 | EB97B4B3EE42C8C3F6FFB75C7C843BF7 |
| SHA-1 | D5668BE2A066682FC7DC1F5AF56BEBDF733729AA |
| SHA-256 | 5439ED2D25227629B57FCF472FD5946832292792630D855351AC5DCDD51F7ACA |
| SSDEEP | 12:zHHkrnhL/F19akrnhL/F6DAj0YBCkrnhL/F1k/WOkrnhL/FD/9:znk79F7ak79F6+9Ek79F+eOk79FDl |
| TLSH | T184E09B65E2C49C3791AF4F5AC7A2DB74D15151C8E6F3F7C4D8C8513309536011A854FE |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/libgromacs5/copyright |
| FileSize | 30450 |
| MD5 | F62B0E354DDC5702D6CAAC8224B8E188 |
| SHA-1 | 8934DB79E17F71E791D6F9F2E828EE2B95410A35 |
| SHA-256 | B92B8CC7E2AAA47DC7D6B75FB1D8CA576AF1C35407FCA872DE7668C79640EB6C |
| SSDEEP | 768:vZtl2Roba/tyvJDLAfiIqBd3j12lRDLwjFljAsGw2Vjlbqxb+Fo7W1:H4/svJAfi9n2lRoljAsGw2VBWW2W1 |
| TLSH | T18FD2F86B334403B319E20791A65998C9F22F913E77276A44787DD208233BB2DDBFB494 |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/libgromacs5/changelog.Debian.gz |
| FileSize | 16539 |
| MD5 | 808F648F998945BDF1DE7CEBE8AC0A80 |
| SHA-1 | DC5C2522DC3023346ED1276BA6B797EA3017C58E |
| SHA-256 | 61F3287DD85890288F2FDCCE241ACD043D425AB7DA3380740B4FFB2EAC564C9F |
| SSDEEP | 384:UImZKYFrUf5mukZs1Gk6roVeoQi/4YDhLYYO9fGfLF+8:UIQrM1Kk6roVeoPlKMzFp |
| TLSH | T1C072C02C3A9B681574A097F1BE18C7B1B1542DFFF9BAF3D5359B2D5128C8B2749C0444 |
| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi_d.mpich |
| FileSize | 57 |
| MD5 | 4B88CD4FC7A83B076366DB8B38DAC11E |
| SHA-1 | ADFD495180BA327060FE0D4A5B389B17065CBB92 |
| SHA-256 | 2CC7C2CD5335FB9EDC0AF8E9B57BAC6265255BE5ADF542087572EB27F991B170 |
| SSDEEP | 3:OJb1LHL6MTjFHnVna:mR/6MtVa |
| TLSH | T19D90029242D5C46A01D2CD44A1948070CA90554D66D85240906054219C98B1294CD5AA |