Subject: parameters for OPLS/AMBER

From: Caroline Taylor <[email-masked]>
Date: Wed, 22 May 2002 15:08:09 -0500 (CDT)

We are doing some implicit solvent simulations on polymers, but the
necesssary parameters are not included in the potentials. Does anybody
know where we might find them? 

We are studying chains of polyethylene oxide and polypropylene oxide:
[-CH2-CH2-O]n-  and -[CHCH3-CH2-O]n-
and need parameters for the ether linkages and the alkane groups for OPLS
and/or AMBER.

Thanks in advance!

-Caroline Taylor

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Caroline M. Taylor
Department of Chemistry
University of Chicago, James Franck Institute
5640 S. Ellis Avenue
Chicago, Illinois 60637
(773) 702-7223
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