On Wed, May 22, 2002, Yuguang Mu wrote:
> The paper is :
> Automatic parameterization of force field by systematic search and genetic
> algorithms
> Wang JM, Kollman PA
> JOURNAL OF COMPUTATIONAL CHEMISTRY
> 22 (12): 1219-1228 SEP 2001
>
Actually, in "parm99.dat" (where most of these appear), the reference is to
the following:
%A J. Wang
%A P. Cieplak
%A P.A. Kollman
%T How well does a restrained electrostatic potential (RESP) model perform
in calcluating conformational energies of organic and biological molecules?
%J J. Comput. Chem.
%V 21
%P 1049-1074
%D 2000
....dac
--
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David A. Case | e-mail: case_at_scripps.edu
Dept. of Molecular Biology, TPC15 | fax: +1-858-784-8896
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Received on Wed May 22 2002 - 08:05:23 PDT
