# LAM MPI RUNTIME ENVIRONMENT sample script for Gromacs
if [ "x$1" = "x0" ] ; then
    eval $joboption_env_0
    eval $joboption_env_1
    export RUNTIME_PBS_NODES
    export RUNTIME_PBS_PPN
fi
if [ "x$1" = "x1" ] ; then
        . /opt/gromacs-4.0/bin/GMXRC.bash
        /usr/bin/lamboot
        export GMX_MPIRUN="mpirun"
fi
if [ "x$1" = "x2" ] ; then
        /usr/bin/lamhalt
fi