[gmx-users] Phosphotyrosine

David van der Spoel spoel at xray.bmc.uu.se
Wed Apr 17 22:21:26 CEST 2002


On Wed, 17 Apr 2002, Satyan Sharma wrote:

>Hi all,
>Does anybody has the topology for phosphotyrosine.
>I have tried to make my own and facing a few problems.
>The oxygen (OS) connecting CZ and P is moving out of
You probably need more impropers. If this is part of a protein you will 
want to edit the rtp and hdb file for the forcefield of your choice.

-- 
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, 	Biomedical center, Dept. of Biochemistry
Husargatan 3, Box 576,  	75123 Uppsala, Sweden
phone:	46 18 471 4205		fax: 46 18 511 755
spoel at xray.bmc.uu.se	spoel at gromacs.org   http://zorn.bmc.uu.se/~spoel
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