Re: Space environment simulations

From: carlos n. a. (carlosjavierna_at_hotmail.com)
Date: Tue May 10 2005 - 16:02:28 CDT

Hi,

I think that high temperature conditions is not recommended for molecular
dynamics simulations. All the force fields are parameterized for room
temperature condition. If you want run MD calculations at high temperature
you probably need re-parameterize the force field before.

Best wishes
Carlos N.

_________________________________________________________________
Donít just search. Find. Check out the new MSN Search!
http://search.msn.click-url.com/go/onm00200636ave/direct/01/

This archive was generated by hypermail 2.1.6 : Wed Feb 29 2012 - 15:40:45 CST