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:
>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.
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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