Excuse me, my fault...
Please ignore that email.
Regards,
Mahmood
On Mon, Sep 28, 2020 at 11:34 PM Mahmood Naderan
wrote:
> Hi
> With "cpu=48,mem=40G" limits and the following script
>
> #!/bin/bash
> #SBATCH --job-name=gr
> #SBATCH --output=my_gr.log
> #SBATCH --partition=SEA
> #SBATCH --ac
Hi
With "cpu=48,mem=40G" limits and the following script
#!/bin/bash
#SBATCH --job-name=gr
#SBATCH --output=my_gr.log
#SBATCH --partition=SEA
#SBATCH --account=fish
#SBATCH --mem=6GB
#SBATCH --nodes=4
#SBATCH --ntasks-per-node=20
mpirun -np $SLURM_NTASKS /share/apps/gromacs-2019.6/single/bin/gmx_m