Hi all,
I was able to get my simulation to restart using the below command.
srun pmemd.cuda -O -i md_WT4.in -p sim_cg.prmtop -c md.ncrst -o md_2.out -r md_2.ncrst -x md_2.nc
I have noticed that my restart efficiency is 3 times slower than my initial efficiency. Has anyone else noticed this/is there a potential fix for this?
Kind Regards,
Niamh
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Received on Mon Apr 20 2026 - 09:00:03 PDT
