Spin Relaxation and Chemical Exchange in NMR Simulations

Theory for describing the density matrix of a spin system experiencing chemical exchange and relaxation during the steps of an NMR experiment is presented in a form suitable for computation. Features in the theory that arise from exchange are discussed in detail, and comparisons to the exchange-free...

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Published in:Journal of magnetic resonance (1997) 2000-01, Vol.142 (1), p.11-23
Main Authors: Cuperlovic, Miroslava, Meresi, Ghirmai H, Palke, William E, Gerig, J.T
Format: Article
Language:English
Subjects:
chemical exchange
Computer Simulation
Floxuridine - chemistry
Humans
Magnetic Resonance Spectroscopy
relaxation
spectral simulation
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description Theory for describing the density matrix of a spin system experiencing chemical exchange and relaxation during the steps of an NMR experiment is presented in a form suitable for computation. Features in the theory that arise from exchange are discussed in detail, and comparisons to the exchange-free situation are made. A general computer program to carry out simulations of NMR experiments is described, and several examples of its performance are presented.
doi_str_mv 10.1006/jmre.1999.1812
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subjects chemical exchange
Computer Simulation
Floxuridine - chemistry
Humans
Magnetic Resonance Spectroscopy
relaxation
spectral simulation
title Spin Relaxation and Chemical Exchange in NMR Simulations
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