Hi All,<br>Can anyone please tell me how to define simulation time in a mdp file. I have the following mdp file and I want to run a simulation for 50 nano seconds. How should I define it in this mdp file?<br><br>;<br>; User spoel (236)<br>; Wed Nov 3 17:12:44 1993<br>; Input file<br>;<br>cpp = /usr/bin/cpp<br>define = -DFLEX_SPC<br>constraints = none<br>integrator = steep<br>nsteps = 1000<br>;<br>; Energy minimizing stuff<br>;<br>emtol =
100<br>emstep = 0.01<br><br>nstcomm = 1<br>ns_type = grid<br>rlist = 1<br>rcoulomb = 1.0<br>rvdw = 1.0<br>Tcoupl = no<br>Pcoupl = no<br>gen_vel = no<br><br>Any suggestion is welcome.<br><br>Regards,<br><BR><BR><DIV><FONT color=#0000bf size=4></FONT> </DIV> <DIV><FONT color=#0000bf><STRONG>Anirban
Ghosh</STRONG></FONT></DIV> <DIV><FONT color=#0000bf><STRONG>M.Tech Bioinformatics</STRONG></FONT></DIV> <DIV><FONT color=#0000bf><STRONG>University of Hyderabad</STRONG></FONT></DIV> <DIV><FONT color=#0000bf><STRONG>Hyderabad - 500 046</STRONG></FONT></DIV> <DIV><FONT color=#0000bf><STRONG>Andhra Pradesh</STRONG></FONT></DIV> <DIV><FONT color=#0000bf><STRONG>India</STRONG></FONT></DIV><p> 
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