From owner-chemistry@ccl.net Fri Jul  4 09:58:01 2008
From: "Simon Halstead shalstead]*[hit.edu.cn" <owner-chemistry(_)server.ccl.net>
To: CCL
Subject: CCL: MM3 forcefield format
Message-Id: <-37292-080704001156-10425-bvNxekP5mXUoFpr+u4/7vQ(_)server.ccl.net>
X-Original-From: "Simon  Halstead" <shalstead]-[hit.edu.cn>
Date: Fri, 4 Jul 2008 00:11:52 -0400


Sent to CCL by: "Simon  Halstead" [shalstead-#-hit.edu.cn]

Dear all,

I am trying to perform some simulations using the MM3
forcefield. However, I cannot find any explanation of
the format of the forcefield.
Could anyone please give me a brief description of the
format of the forcefield (the form of the different
terms and the various units too)? I already have all
the different parameters, but unfortunately I only
have access to journals that are available online.

(My apologies if this is a repost, but I have not seen my original message appear)

Thank you for your help,

Simon Halstead