RE: Nanotube Simulations

From: Michel Espinoza-Fonseca (
Date: Tue Aug 02 2005 - 09:50:18 CDT

Yes, it is possible. Somewhere in the list you can find the link to get
the topology and parameters for nanotubes. Try to look for them! I'll
also try to look for them.

-----Original Message-----
From: [] On
Behalf Of Gaurav Sharma
Sent: Tuesday, August 02, 2005 8:51 AM
Subject: namd-l: Nanotube Simulations

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.

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