[gmx-users] pdb2gmx not recognizing disulfides
David van der Spoel
spoel at xray.bmc.uu.se
Sun Jul 1 10:44:52 CEST 2007
Russell Green wrote:
> Hello,
>
> I'm having problems with pdb2gmx not recognizing disulfides in my
> protein. I've tried chaning the residue name and -ss flag but neither
> works. I read that this was a known bug on the website. Does anyone have
> a fix for this?
please submit a bugzilla if there isn't one already. don't forget to
upload an example file.
>
> Thanks,
> Russell Green
>
>
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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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