Incidentally, sequence corrections for secondary chemical shifts appear in
v1.1, given that these are needed by the dihedral angle prediction program
DASH (or whatever it is eventually named). Also, RCI may appear too.
T.
> The new version of SecStructureGraphPopup.py is fine to go on the
> update server, so I have just uploaded it.
>
> Along with the fix for carbonyls, you lucky people get the following v1.1
> improvements a bit early:
>
> Persistence of the secondary structure type, so that it is remembered
> after you reload a project.
>
> Toggling of the secondary chemical shift columns, so you can select Ca,
> Cb, CO and Ha separately. - Thus remove unused lines from the plot.
>
> Calculation of CSI directly built into Analysis (As near as I can get
> from the Wishart papers).
>
> Inbuilt prediction of whether a Cys residue is oxidised or reduced (from
> Cb shifts) so you don't get screwy secondary chemical shifts.
-------------------------------------------------------------------------------
Dr Tim Stevens Email: [log in to unmask]
Department of Biochemistry [log in to unmask]
University of Cambridge Phone: +44 1223 766018 (office)
80 Tennis Court Road +44 7816 338275 (mobile)
Old Addenbrooke's Site +44 1223 364613 (home)
Cambridge CB2 1GA WWWeb: http://www.bio.cam.ac.uk/~tjs23
United Kingdom http://www.pantonia.co.uk
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