> > Yep, shouldn't be so much trouble. I'll put it on the to-do list. - The
> > issue was that this was implemented before we had proper experimental
> > type definitions to know which C-C transfers to work with. So the natural
> > question is: what type of experimental transfers should this use?
> > SpinDiff?
> >
> In the current implementation that is indeed the transfer that I specify
> when loading C-C spectra into analysis (even though that is not the
> actual transfer mechanism used in many of our C-C experiments).
>
> However, aside from the issue of C-C transfer mechanisms (and C-N
> transfer mechanisms), I thought it might be useful to have a general
> tool for showing the relative positions of two sites/nuclei (independent
> of what experiment we are talking about). I did not actually realize
> that it needs to know the transfer mechanism (I seem to remember being
> able to access this from the resonance shift list, which is not
> specifically correlated to any particular experiment type?).
The point is that distances between arbitrary nuclei is fine in some
circumstances (like restraints) but not in others where knowledge
of the transfers is needed to work out which of several possibilities is
relevant (like the assignment popup).
If I implement C-C distances, I would want to do it fully at every spot
once, which includes both of the above situations. If I only did one and
not the other I would be making more work and inviting comments about
missing features.
T.
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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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