Hi I am facing this strange problem of segmentation fault while executing mpi-enabled gromacs executables on remote server.
I source GMXRC, so that I can access executables from any directory without specifying full path of gromacs/bin. And when I execute, say grompp, I get segmentation fault. But when I use the same command by specifying full path /home/.../gromacs/bin/grompp , it executes without any issues!! Whats wrong going on here? thanks sikandar
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