VMD-L Mailing List

From: John Stone (johns_at_ks.uiuc.edu)
Date: Mon Nov 22 2004 - 21:11:43 CST

Phil,
  While you don't have to do it manually, you'd need to write a script
to generate and query the various angle combinations you're interested in:
  http://www.ks.uiuc.edu/Research/vmd/current/ug/node117.html

Let us know if you need more help.

  John Stone
  vmd_at_ks.uiuc.edu

On Fri, Nov 19, 2004 at 04:21:44PM -0700, Philip Blood wrote:
> Hi,
>
> Is there a straightforward way to output a list of all the bond, angle,
> and dihedral interactions in a molecule without have to specify each
> pair (or trio, etc) manually? I have looked through some of the
> scripting commands for the first time today, so I am very new at this.
> I appreciate your help.
>
> Phil
> 

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NIH Resource for Macromolecular Modeling and Bioinformatics
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