Parameter resetting in NAMD

From: Himanshu Khandelia (
Date: Thu Mar 09 2006 - 10:26:55 CST


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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