I see from the release notes and from some posts that it is possible to
create synthetic peak lists from chemical shift lists:
http://www.jiscmail.ac.uk/cgi-bin/webadmin?A2=ind0701&L=CCPNMR&P=R4023&I=-3&X=39692035BD012ABB41&Y=garyt%40bmb.leeds.ac.uk
Hi
Is there any way to generate synthetic peak lists for 3D spectra other than
HNCO? I am trying to use "Predict from Shifts" feature but I only get the
option to select HSQCs and HNCO
Cheers
Ben
http://www.jiscmail.ac.uk/cgi-bin/webadmin?A2=ind0611&L=CCPNMR&P=R3792&I=-3&X=39692035BD012ABB41&Y=garyt%40bmb.leeds.ac.uk
Added options to create synthetic peaklists. These include synthetic NOEs
from a structure, a peaklist using shifts from correlated resonances (e.g.
make 2D 13C-HSQC from higher dimensionality assignments), and a function
to make a transposed peaklist from an existing one.
However, thoug i can see that it is possible i cant see how to do it,
help!
regards
gary
--
-------------------------------------------------------------------
Dr Gary Thompson
Astbury Centre for Structural Molecular Biology,
University of Leeds, Astbury Building,
Leeds, LS2 9JT, West-Yorkshire, UK Tel. +44-113-3433024
email: [log in to unmask] Fax +44-113-2331407
-------------------------------------------------------------------
|