[gmx-users] About NME group construction

[David van der Spoel]

On Tue, 15 Feb 2005 ygao at phase1.unl.edu wrote:

>
>Hi,
>
>I want to construct -NHME group in GROMACS. Would you kindly tell me how
>to construct it, or use any existing parameter to replace it, such as
>ffG43a1 force field?
>
Check what's available already. Otherwise just mutate a Gly residue in the 
rtp and hdb files.

>Yi Gao
>
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-- 
David.
________________________________________________________________________
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596,  	75124 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://xray.bmc.uu.se/~spoel
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