[gmx-users] Extending MD simulations

soumadwip ghosh soumadwipghosh at gmail.com
Thu Dec 28 23:45:31 CET 2017


Hi Akash,

The correct command would be:

gmx mdrun -s new.tpr -v -deffnm md_0_1 -cpi md_0_1.cpt ( -append option is
optional) . This should start appending your files from the previous 60 ns
simulation.

Best,
Soumadwip Ghosh


More information about the gromacs.org_gmx-users mailing list