[gmx-users] simulation stopped , restart from end point but missing remaining time datas

Nikhil Maroli scinikhil at gmail.com
Thu Dec 3 06:50:16 CET 2015


Dear all,
im running a protein-ligand simulation for 100ns ,but it terminated at 60ns
(by mistake i pressed ctl+c) so i gave this command to restart the
simulation

gmx mdrun -nt 30 -v  -s md_0_1.tpr -cpi md_0_1_prev.cpt -gpu_id 0

now simulation is over after 100ns when im checking the output file
md_0_1.xtc its having upto 60ns only
log file also not updated
it will be very helpful if anyone can help me out here


-- 
Ragards,
Nikhil Maroli


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