Subject: CCL: good parameters for chloroform, acetonitrile, and DMSO used with the CHARMM force field for NMA

From: Tomoyuki Hayashi <tomoyukh<<at>>uci.edu>
Date: Fri, 19 Nov 2004 16:49:01 -0800

Dear All:

I want to do a simulation of N-methyl acetamide(NMA) in several solvents,
but I can't find the parameters for chloroform, acetonitrile and DMSO in
CHARMM.
Can anyone give me the best force field parameters for them combined
with the CHARMM force field (found in top_all22_model.inp file) for NMA?

-- 
Tomoyuki Hayashi <tomoyukh<<at>>uci.edu>