[gmx-users] Re:Regarding D-Alanine paramters
David van der Spoel
spoel at xray.bmc.uu.se
Thu Jul 12 14:04:52 CEST 2007
naga raju wrote:
> Dear gmx users,
> Dear Dr.Mark and Dr.David thank you
> for your suggestion. I would like to use OPLS_AA force
> field to my protein.
then you only need to get a correct starting structure.
Once more, check chapter five and your topology at the appropriate place.
>
> with best regards,
> Nagaraju.
>
>
>
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--
David van der Spoel, Ph.D.
Molec. Biophys. group, Dept. of Cell & Molec. Biol., Uppsala University.
Box 596, 75124 Uppsala, Sweden. Phone: +46184714205. Fax: +4618511755.
spoel at xray.bmc.uu.se spoel at gromacs.org http://folding.bmc.uu.se
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