Last installed version : 2023.3
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Description
GROMACS, which stands for “GROningen MAchine for Chemical Simulations,” is widely used molecular simulation software in the fields of computational chemistry, biochemistry, and biophysics. It allows the simulation of the behavior of molecules in complex systems, such as proteins, lipids, and nucleic acids, using the principles of molecular dynamics.
Set up the environment and version
ml simulation/gromacs
Tutorial
coming soon