| Key | Value |
|---|---|
| FileSize | 4495372 |
| MD5 | C483AD80E6A678CDA8EE0F9F5A65AFA9 |
| 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 | 354CFF559115842E81CFEC3A99E23D734CE927BE |
| SHA-256 | BB9619C2C5D28257D1093820F77347A97BD9662282BCBF4836E4E156008DD887 |
| 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/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/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/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/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/bin/mdrun_mpi_d.mpich |
| FileSize | 7428208 |
| MD5 | 68A5E3A6C2F2E2DADAD92A3C5C354E21 |
| SHA-1 | DAD4AD7515C48498C8A5436462AA5D63EA8EED78 |
| SHA-256 | A64484137E85DF9FE293C06E4DE175BCA94BD690034D3785FE869115A5F6A590 |
| SSDEEP | 98304:NMOYGyVKetBuaiSTeCpLUnyEJWM/Vmu1YaTpS6cTpS66bs7xvsOxpGd+QLyEdmUa:NPyVNuvSTe8PwXLyEdzA1MTW4u |
| TLSH | T18676AD23330DAB53DB426C3B879DBC50739535850B2948967A44030FEFBD62ACB5AE5E |
| 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/bin/mdrun_mpi.mpich |
| FileSize | 7493744 |
| MD5 | C467BCCE2796B22B479E055FF873E605 |
| SHA-1 | AFE83F4AAF60F9908F525E6A6F3DD43BEFD096C9 |
| SHA-256 | 0F63772AA15D86F39FD28CEC64B3D8E9F0CFCFFE906B372E031ECB950F81F988 |
| SSDEEP | 98304:KU7wEYyI9n2RXjh9X0tUxETBHFmxTn/gUJyxbP4pE5:KU7wD2zPXtE1HQ/1EV |
| TLSH | T17476AF63330DAA53DB429C3B479DBC61739539460B2458967A44030FFFBDA2ACB1AE4D |
| 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 |