VMD-L Mailing List

From: John Stone (johns_at_ks.uiuc.edu)
Date: Thu Jun 28 2007 - 13:07:51 CDT

Hi,
  You'll need to be sure to load a structure file that contains
charge information (e.g. PSF, Amber parm/prmtop, etc.)

Cheers,
  John Stone
  vmd_at_ks.uiuc.edu

On Thu, Jun 28, 2007 at 10:56:46AM -0700, lily jin wrote:
> I use '$sel get charge', it seems that all atoms have zero charge. How can I get the partial charge of an atom?
> Thanks!
>
> Lily
>
>
>
> ____________________________________________________________________________________
> Get the Yahoo! toolbar and be alerted to new email wherever you're surfing.
> http://new.toolbar.yahoo.com/toolbar/features/mail/index.php 

-- 
NIH Resource for Macromolecular Modeling and Bioinformatics
Beckman Institute for Advanced Science and Technology
University of Illinois, 405 N. Mathews Ave, Urbana, IL 61801
Email: johns_at_ks.uiuc.edu                 Phone: 217-244-3349
  WWW: http://www.ks.uiuc.edu/~johns/      Fax: 217-244-6078