[gmx-users] Extend the protein simulation

farial tavakoli farial.tavakoli at ymail.com
Thu Jul 27 16:52:56 CEST 2017

 blockquote, div.yahoo_quoted { margin-left: 0 !important; border-left:1px #715FFA solid !important; padding-left:1ex !important; background-color:white !important; }  Dear gromacs users
I am using GROMACS 2016.3 and run a MD simulation on my protein for 1ns which is 500000 steps using dt=0.002. My laptop was turned off and now i need to continue simulation. I checked my .log file and found the last step is 240000 and time is 480.00000 . But when i issued this command:
Tpbconv -s md_0_1.tpr -extend 240000 -o md.tpr
encountered this error:
Fatal error:Reading tpx file (topol.tpr) version 110 eith version 83 program
Would you please help me to fix it?
Thanks in advanceFarial

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