Install Mdrun_openmpi_d On A Debian, Ubuntu, Kali, Fedora And Raspbian
Install mdrun_openmpi_d
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Debian
apt-get install gromacs-openmpi
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Ubuntu
apt-get install gromacs-openmpi
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Kali Linux
apt-get install gromacs-openmpi
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Fedora
dnf install gromacs-openmpi
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Raspbian
apt-get install gromacs-openmpi
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gromacs-openmpi
Molecular dynamics sim, binaries for OpenMPI parallelizationGROMACS 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.