I've done a search on the subject, and found an old script from some time
last year. This script should be build in to the latest release of CCPNMR,
but I cannot figure out where it is, or how it works. I haven't tried to run
the old script yet, though... My problem is describe in the following:
I have imported a chemical shift list from AutoAssign using formatConverter,
and have run the linkResonances. Now the situation is that I have my
original shift list and the new shiftlist I've called autoassign. When
looking at the molecules::atom browser, I can see that using the old shift
list I have no assignments, but using my new autoassign shift list all the
imported assignments are present. How do I copy these assignments to my peak
list??? Furthermore, I have by mistake deleted peaks in some of my spectra,
is it possible from the autoassign shift list to create peaks in these
spectra with the correct assignment?
Kind regards
Robert
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