From: Himanshu Khandelia (hkhandel_at_dtc.umn.edu)
Date: Thu Mar 09 2006 - 10:26:55 CST
Hi,
I was trying to equilibrate a simulation with a smaller time step, and
then use a larger time step to run it, in the same config file. So I used
something like this:
timestep 1
# equlibration etc...
timestep 2
# dynamics etc ...
However, NAMD did not allow me to reset the timestep. How does one work
around this ? Thanks for the inputs !
===================================================
Himanshu Khandelia
Doctoral Candidate,
Kaznessis Research,
Department of Chemical Engineering and Materials Science,
University of Minnesota
Mailing Address:
499, Walter Library,
117, Pleasant St. SE,
Minneapolis, MN 55455
Phone(o): 612-624-4945
===================================================
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