| Key | Value |
|---|---|
| FileSize | 6371222 |
| MD5 | BED2A75FEACC06A661E00E80316981EE |
| PackageDescription | Molecular dynamics sim, binaries for OpenMPI 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 OpenMPI 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-openmpi |
| PackageSection | science |
| PackageVersion | 2016.1-2 |
| SHA-1 | C22A67437B565CC0805A7EF372312D8270B93C7C |
| SHA-256 | 590A6BD8E5CF53D9E5B5A7605349C99F395FE851FF240F9D770C0FBD8B33F7A1 |
| 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.openmpi |
| FileSize | 10376616 |
| MD5 | 156E0FF9E28479B8F4C6F4DBBF519A2F |
| SHA-1 | 1C7AEA95CECB7AB6984A07AF7830185F020CB97F |
| SHA-256 | 541891A2E13E2DABBD1F01AB68C154A7661ACBEA3D3AE4C91AC9AE08C9694C1A |
| SSDEEP | 196608:xMVcJloYgs1aNhGIqCbhWiFx8IdCCSGjA6tFyFWYbCJu2SE7cpU7a+Dq8TXayTNM:FJlIP8tIdCCSGj77c16zqS2k |
| TLSH | T11DA60750EFEEAAE0DE920CF1502F6539D4603F074016B1B6FFE02A54AE96B9C41729D7 |
| Key | Value |
|---|---|
| FileName | ./usr/bin/mdrun_mpi_d.openmpi |
| FileSize | 10753416 |
| MD5 | 0A68A3DE2E52B070BB094C81428B2618 |
| SHA-1 | AAFE0FE500FB5EE4B24C3AB60BBCB384536EE5C1 |
| SHA-256 | 0FD6F745E0DC2A57C4C51A1AE691C883FB1C20D2456B62226806E35927BCF805 |
| SSDEEP | 196608:9MXuNepsfrNL751iIWxuVfA6G4/Lth93zcg4k:euNeWfrNL91iBxuVfA61/b4k |
| TLSH | T184B60640EBF39EF1E3820CF817573439D8182F21045E6DFA9FD01A869EB5784AA6D857 |
| Key | Value |
|---|---|
| FileName | ./usr/share/lintian/overrides/gromacs-openmpi |
| FileSize | 220 |
| MD5 | 1A3E90740CE222FB6631BBF1686BA4C3 |
| SHA-1 | D4AE54ED72EF7F12329581E09A48031AB8B3AE5A |
| SHA-256 | A02A8AD2E69D285065BBA2B9935EE965584A82E9E824FD15B57DD8361D166C4A |
| SSDEEP | 6:SLQa2JbMOAoesrLyahL/FLSVqjIwTW6AoesrLyahL/FLSVxIwTWo:zHHAodrnhL/F/jIwtAodrnhL/F8Iwt |
| TLSH | T1D5D0A7A9D1C45037614F0E96C2CE96705380F088BA21FA855F8883930A4251A1E4546C |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/libgromacs2/copyright |
| FileSize | 21568 |
| MD5 | 15982510C6CA33F14C8C180C55C8E499 |
| SHA-1 | 529543E9A3B42F118C104207C6F8D19C7469898B |
| SHA-256 | 391576D84ACBD271000C0A06991B3996EDAD3670F9D89F7252D33778CF6BA28D |
| SSDEEP | 384:SZtlNSU3RyVCUaos86tyrscrsk1DLAfrsBrsJjDqBd3R7dhf7L/3fLrsCrsRm1D4:SZtlVRoBa/tyvJDLAfiIqBd3j1LlRDLs |
| TLSH | T1E3A2092B734803B319E206A1B64999C8F21F813E77275A84787DD21C233BB2DDAF7095 |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/gromacs-openmpi/README.Debian |
| FileSize | 798 |
| MD5 | AF63DA52304E006F3FE8DFF8D9C22365 |
| SHA-1 | D1C7F317A46AA0D135F06DEA00AE1F4A76AEDFE6 |
| SHA-256 | 61C457D19226087583D2C31130EC1368EF081B387AAB32CE5ADD17EF56EEB98A |
| SSDEEP | 24:T7dFp/0gARrMe/l7AOsfDbh0JXFDuF4fO7:TBVCrM9OGiJlJf8 |
| TLSH | T12701153DBDC8936010C2D995D20C59D8C329851817BCC581395D765D8B0043627DFD76 |
| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi.openmpi |
| FileSize | 57 |
| MD5 | DE33869B41EF132EA6AEB41D4E77AEFC |
| SHA-1 | 04B069CA202F35160587D309CC6718FFE8C54F4A |
| SHA-256 | 97D174E0E5DA883099180E9C739DB82C61DF06F7EEDCAFDBCC1E05CFE893A588 |
| SSDEEP | 3:OJb1LHL6MTjFHnVKTR:mR/6MtVqR |
| TLSH | T1A190029282D5C06A01D2CD54E1844075CAD0958927985640512014619D5971A98CD5BA |
| Key | Value |
|---|---|
| FileName | ./usr/share/man/man1/mdrun_mpi.openmpi.1.gz |
| FileSize | 5884 |
| MD5 | 44A2F3D28262BB2866DEC2CC4660646E |
| SHA-1 | FF6FCB81C2BD25F1E0AB09B6C28E264EDC1FE1EC |
| SHA-256 | C607C60CBA7DC171E57E5A184A1B7257EB32645889B6D1349AF9C76E4601A8C8 |
| SSDEEP | 96:k6CtI2vKIknD8IWX+VLIZbbR4XWoAYlMxl+W96KVX3reH+RWnAFJMK5h9uP6I7i/:kNbZE8IWmUbdTCY3YnP0h9uhmKW |
| TLSH | T1B4C19E5B9DE0E8A5F50FD49C0082B8A7E3E4EC239100446976DD975C807F711C4F19E6 |
| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi_d.openmpi |
| FileSize | 59 |
| MD5 | 21ACEFEBA9F4276C423FB89E2540ABBE |
| SHA-1 | 954B538CB6D223C314D5DE33389BD54F6CB4890F |
| SHA-256 | D924FAB89D56C3229CA91C530F4175070B05A32C4C218C73F29DA3E79EF63C05 |
| SSDEEP | 3:OJb1LHL6MTjFHnVL:mR/6MtVL |
| TLSH | T1C9A0029242D5C06A01D2DD44E1888070CBD0954D66985640522015619D9871794CD5AA |
| Key | Value |
|---|---|
| FileName | ./usr/share/doc/libgromacs2/changelog.Debian.gz |
| FileSize | 12641 |
| MD5 | C08ACF8DC90AE800B961E44CE5D6894B |
| SHA-1 | 7EE079C5E696A5300FD258539AC1439D8D29B98D |
| SHA-256 | D154F6FC8FC50D52D8C5C295A692A6B675EDDECA122F48E06AF0C5D0E68D90BB |
| SSDEEP | 192:YH9Q6ITRYlT5WcuN8Z1HG21YQvCg5hdB1BzQZ9YXAE4+OqRtnKR8uvNvonif+1UC:RRQY9NYNZYQ7/BzQZ9BE4oUHTfhzo/uO |
| TLSH | T15642B01B74591D952BD03494B34101DB23DCACCEEABBFC087AE92A8900279E65CF587D |