From: John Stone (johns_at_ks.uiuc.edu)
Date: Tue Aug 02 2005 - 12:34:58 CDT
Have you had a look at the Nanotube tutorial on our web site?
The data files that go with that tutorial include parameter files for the
nanotubes in the tutorial:
Hope that helps,
On Tue, Aug 02, 2005 at 09:51:14AM -0400, Gaurav Sharma wrote:
> Hi All,
> I have posted a similar question on the list before but met with no
> response. Here is a simpler version:
> Is it possible to do molecular mechanics simulations on carbon nanotubes
> using NAMD?
> If yes, where can I find the required parameter and topology files
> containing the appropriate (brenner's)
> force field potential?
> Any suggestions are welcome.
-- 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
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