| Key | Value |
|---|---|
| FileSize | 4666776 |
| MD5 | 402C0FAEA7D551CD226F206D796698B8 |
| PackageDescription | Molecular dynamics sim, binaries for MPI 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 default MPI interface on the chosen architecture. It is suitable for nodes of a processing cluster, or for multiprocessor machines. |
| PackageMaintainer | Debichem Team <debichem-devel@lists.alioth.debian.org> |
| PackageName | gromacs-mpi |
| PackageSection | science |
| PackageVersion | 2021.4-2 |
| SHA-1 | 06F620A4E9BF1714AA01511E5DDC5E46EAC44869 |
| SHA-256 | 8FCEC5C9D183A145E926D08670532E6409F14407822DC7A222B8F792B6760F58 |
| 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.1.gz |
| FileSize | 5718 |
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| Key | Value |
|---|---|
| FileName | ./usr/share/bash-completion/completions/mdrun_mpi |
| FileSize | 49 |
| MD5 | A2B907FDBE60B2B94A5881D36ED25931 |
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| SSDEEP | 3:OJb1LHL6MTjFHnVM:mR/6MtVM |
| TLSH |
| Key | Value |
|---|---|
| FileName | ./usr/bin/mdrun_mpi |
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| Key | Value |
|---|---|
| FileName | ./usr/bin/mdrun_mpi_d |
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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| Key | Value |
|---|---|
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