Re: Calculating or Outputing Forces

From: Joshua D. Moore (jdmoore_at_unity.ncsu.edu)
Date: Wed Jun 28 2006 - 14:18:56 CDT

Hi,

Would it be difficult to modify NAMD to output the forces in dcd format as
was previously done in version 1.5?

http://www.ks.uiuc.edu/Research/namd/1.5/ug/node26.html

Thanks.

Josh

On Mon, June 26, 2006 10:00 pm, Joshua D. Moore wrote:
> Is NAMD still capable of outputing forces in *dcd like files?
>
> See http://www.ks.uiuc.edu/Research/namd/1.5/ug/node26.html
>
> Or does there exist a script which will do this now from the *dcd
> trajectories?
>
> Thanks.
>
> Josh
>
>
>
>

--------------------------------------------------
Joshua D. Moore
Graduate Student
North Carolina State University
Department of Chemical and Biomolecular Engineering
Box 7905 Centennial Campus
Engineering Building I
911 Partners Way
Raleigh, NC 27695-7905
Phone: (919) 513-2051
Fax: (919) 513-2470
Email: jdmoore_at_unity.ncsu.edu
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