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--- gromacs-software [2018/07/16 15:48]
aorth [Installation]
+++ gromacs-software [2019/11/11 14:48] (current)
aorth
@@ Line 17: / Line 17: @@
 <code>$ module load gromacs/2018.2
 $ gmx</code>
+**Note:** Please use the ''-nt'' option to limit the number of threads launched by gmx to be the same amount as in your SLURM sbatch allocation. See the [[http://manual.gromacs.org/2018-current/user-guide/mdrun-performance.html#running-mdrun-within-a-single-node|gromacs documentation for more information]].
 ===== Installation ======

ILRI Research Computing