Re: [gmx-users] extending a simulation after it get stopped because of queue time limit

On Sat, Feb 25, 2012 at 12:09 PM, priya thiyagarajan < priya.thiyagaraja...@gmail.com> wrote: > hello sir, > > i was performing simulation for 30ns. > due to queue time limit my mdrun stopped at 11.6ns.. then i extended my > simulation using these two commands > > *tpbconv -s md.tpr -extend 2

[gmx-users] extending a simulation after it get stopped because of queue time limit

hello sir, i was performing simulation for 30ns. due to queue time limit my mdrun stopped at 11.6ns.. then i extended my simulation using these two commands *tpbconv -s md.tpr -extend 2 -o newmd.tpr mdrun -s newmd.tpr -o md.trr -c md.gro -e md.edr -g md.log -cpi state.cpt -x traj.xtc -append