Hello,
Tim says:
This was a bug; the default assignment tolerances were used but shouldn't
have been. Now fixed (v2.1.5 and v2.2.1).
Wayne
On Tue, 16 Aug 2011, Matthias Huber wrote:
> Dear all,
>
> I'm trying to use create a synthetic peaklist for a 4D H[C]_H[C].through-space spectrum based on the structure.
> I noticed that ccpn generates the list but only about 50% of the synthetic peaks have an assignment.
> How can that be?
> To predict a peak based on the structure ccpn must look up the shifts for the atoms that are in spatial proximity and should then just assign the peak to those atoms.
>
> Matthias
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