VMD-L Mailing List

From: Axel Kohlmeyer (akohlmey_at_cmm.chem.upenn.edu)
Date: Tue May 27 2008 - 04:39:51 CDT

On Tue, 27 May 2008, Stephan Frickenhaus wrote:

SF> Hello VMD supporters,

hello,

SF>
SF> I want to define forces in vmd for IMD with namd per TCL rather than by
SF> mouse.
SF> Is there a TCL-interface to define/undefine forces on atoms and steer MD
SF> with them from a TCL script/command?

stupid question: why do you want to go through VMD and the IMD
protocol when you can use the TCL interpreter in NAMD directly
to define forces?

cheers,
    axel.

SF>
SF> Thanks in advance,
SF> Stephan
SF>
SF> 

-- 
=======================================================================
Axel Kohlmeyer   akohlmey_at_cmm.chem.upenn.edu   http://www.cmm.upenn.edu
   Center for Molecular Modeling   --   University of Pennsylvania
Department of Chemistry, 231 S.34th Street, Philadelphia, PA 19104-6323
tel: 1-215-898-1582,  fax: 1-215-573-6233,  office-tel: 1-215-898-5425
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If you make something idiot-proof, the universe creates a better idiot.