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VersionInstallation Pathmodulefilecompilercomment
2018.4/sw/chem/gromacs/2018.4/skl/impigromacs/2018.4intelmpi
2018.4/sw/chem/gromacs/2018.4/skl/impi-plumedgromacs/2018.4-plumedintelmpiwith plumed
2019.6/sw/chem/gromacs/2019.6/skl/impigromacs/2019.6intelmpi
2019.6/sw/chem/gromacs/2019.6/skl/impi-plumedgromacs/2019.6-plumedintelmpiwith plumed
2021.2/sw/chem/gromacs/2021.2/skl/impigromacs/2021.2intelmpi
2021.2/sw/chem/gromacs/2021.2/skl/impi-plumedgromacs/2021.2-plumedintelmpiwith plumed

Usage

Load the necessary modulefiles. Note that Intel MPI module file should be loaded first

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