Re: chloroform, dichlormethane f.f.

From: David A. Case <case_at_scripps.edu>
Date: Tue 14 Jan 2003 08:19:24 -0800

On Tue, Jan 14, 2003, Arvid Soederhaell wrote:

>
> Does anybody have the parameters for chloroform or dichlormethane? Or
> maybe you have seen a paper where these molecules are simulated? (No
> matter the forcefield.)
>

There is a chloroform box in solvents.lib, and a frcmod file "frcmod.chcl3"
that may help (all under amber7/dat/leap).

..hope this helps....dac 


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Received on Tue Jan 14 2003 - 08:19:24 PST
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