Re: Problem with the cross term of C NH1 CT1 C NH1 CT1 C NH1

From: Kenno Vanommeslaeghe (
Date: Fri Jul 05 2013 - 16:44:06 CDT

On 07/05/2013 04:47 PM, Kenno Vanommeslaeghe wrote:
> The official parameter releases contain all the necessary terms and they
> always have. You must have been using an adulterated version of
> par_all27_prot_na.prm .

Small correction: that should have been "adulterated or very obsolete".
The versions of this file prior to ~ August 2004 didn't have the
crossterms. But neither did the associated topology files, so as long as
the parameters used in the simulation run are consistent with the topology
used during psf generation, there should not be any "UNABLE TO FIND" problems.

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