Abstract
A general method for the computation of cross peak intensities in ROESY (rotating frame NOE spectroscopy) in illustrated in this paper. A suitable formalism, based on the density matrix theory, enables all the magnetization transfer processes occurring in ROESY, both coherent and incoherent, to be treated in a unified fashion. A Fortran computer program has been used to perform numerical simulations. This treatment aims at extending the range of applicability of ROESY, particularly in the conformational studies of organic and biological molecules by NMR.
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