Switching PSF files during a run.

From: Wang, Boyang (bwang9_at_uic.edu)
Date: Fri Sep 07 2007 - 11:35:35 CDT

Dear all,

I have a quick question about running NAMD.

We are trying to define a parameter during the simulation, and would like
to switch the PSF file of the simulation when the parameter changes to
some value.

We would like to find a way that NAMD automatically changes its PSF file
during one run, depending on the value of this parameter.

So I wonder if there is any way of doing this by writing a script in the
configuration file or else.

Thanks a lot for your consideration.

Boyang.

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:46:56 CST