Hi,
We have got ourselves into a pickle with a project where some
atoms have ended up assigned to different resonance objects in different
peakLists that are in different shiftLists. This is a problem because we
would like to calculate shift differences using the
CalcShiftDifferencePopup which (very sensibly) compares resonance for
resonance, rather than assignment for assignment between the peakLists.
So I would like to go through the assigned resonances in the two
shiftLists sytematically merging the identically assigned ones. Has
anyone done this before or have a snippet of code to offer before I work
it out?
Thanks,
Brian
--
Dr. Brian O. Smith ---------------------- B Smith at bio gla ac uk
Division of Biochemistry & Molecular Biology,
Institute Biomedical & Life Sciences,
Joseph Black Building, University of Glasgow, Glasgow G12 8QQ, UK.
Tel: 0141 330 5167/6459/3089 Fax: 0141 330 8640
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