Reference Deconvolution, Phase Correction, and Line Listing of NMR Spectra by the 1D Filter Diagonalization Method

Journal of Magnetic Resonance

Volumn 134, Issue 1, 1998, Pages 76-87

  Hu, Haitao ^a   Van, Que N ^a   Mandelshtam, Vladimir A ^a   Shaka, A J ^a  

^a UNIVERSITY OF CALIFORNIA   (United States)

Author keywords

FDM; Filter diagonalization method; Line list; Linear prediction; NMR; Phase correction; Reference deconvolution

Indexed keywords

ARTICLE; FOURIER ANALYSIS; KINETICS; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; THEORETICAL MODEL;

FOURIER ANALYSIS; KINETICS; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, THEORETICAL; NUCLEAR MAGNETIC RESONANCE, BIOMOLECULAR;

EID: 0032165891     PISSN: 10907807     EISSN: None     Source Type: Journal    
DOI: 10.1006/jmre.1998.1516     Document Type: Article

References (27)

1. M. R. Wall and D. Neuhauser, Extraction, through filter-diagonalization, of general quantum eigenvalues or classical normal mode frequencies from a small number of residues or a short-time segment of a signal. I. Theory and application to a quantum-dynamics model, J. Chem. Phys. 102, 8011-8022 (1995).
2. V. A. Mandelshtam and H. S. Taylor, Spectral analysis of time correlation function for a dissipative dynamical system using filter diagonalization: application to calculation of unimolecular decay rates, Phys. Rev. Lett. 78, 3274-3277 (1997).
3. V. A. Mandelshtam and H. S. Taylor, Harmonic inversion of time signals and its applications, J. Chem. Phys. 107, 6756-6769 (1997).
4. V. A. Mandelshtam and H. S. Taylor, Multi-dimensional harmonic inversion by filter diagonalization, J. Chem. Phys. 108, 9970-9977 (1998).
5. V. A. Mandelshtam, H. Hu, and A. J. Shaka, Two-dimensional HSQC NMR spectra obtained using a self-compensating double pulsed field gradient and processed using the filter diagonalization method, Magn. Reson. Chem. (in press).
6. H. Barkhuijsen, R. de Beer, W. M. M. J. Bovée, and D. van Ormondt, Retrieval of frequencies, amplitudes, damping factors, and phases from time-domain signals using a linear least-squares procedure, J. Magn. Reson. 61, 465-481 (1985).
7. J. Tang and J. R. Norris, LPZ spectral analysis using linear prediction and the z-transform, J. Chem. Phys. 84, 5210-5211 (1986).
8. H. Gesmar and J. J. Led, Spectral estimation of complex time-domain NMR signals by linear prediction, J. Magn. Reson. 76, 183-192 (1988).
9. D. S. Stephenson, Linear prediction and maximum entropy methods in NMR spectroscopy, Prog. NMR Spectrosc. 20, 515-626 (1988).
10. G. Zhu and A. Bax, Improved linear prediction for truncated signals of known phase, J. Magn. Reson. 90, 405-410 (1990).
11. R. de Beer and D. van Ormondt, Analysis of NMR data using time domain fitting procedures, NMR Basic Prin. Prog. 26, 201-248 (1992).
12. H. Gesmar and P. C. Hansen, Fast linear prediction and its application to NMR spectroscopy, J. Magn. Reson. Series A 106, 236-240 (1994).
13. Y.-Y. Lin, P. Hodgkinson, M. Ernst, and A. Pines, A novel detection-estimation scheme for noisy NMR signals: Applications to delayed acquisition data, J. Magn. Reson. 128, 30-41 (1997).
14. J. C. Hoch and A. S. Stern, "NMR Data Processing," Wiley-Liss, New York (1996).
15. S. Marple, Jr., "Digital Spectral Analysis with Applications," Prentice-Hall, Englewood Cliffs, NJ (1987).
16. R. Roy, B. G. Sumpter, G. A. Pfeffer, S. K. Gray, and D. W. Noid, Novel methods for spectral analysis, Comput. Phys. Rep. 205, 109-152 (1991).
17. J. Tang and J. Norris, LP-ZOOM, a linear prediction method for local spectral analysis of NMR signals, J. Magn. Reson. 79, 190-196 (1988).
18. C. B. Moler and G. W. Stewart, An algorithm for generalized matrix eigenvalue problems, SIAM J. Numer. Anal. 10, 241-256 (1973).
19. A. Bax, R. Freeman, and G. A. Morris, A simple method for suppressing dispersion-mode contributions in NMR spectra: the "pseudo echo," J. Magn. Reson. 43, 333-338 (1981).
20. R. Chen and H. Guo, Calculation of matrix elements in filter diagonalization: a generalized method based on Fourier transform, Chem. Phys. Lett. 279, 252-258 (1997).
21. J. C. Lindon and A. G. Ferrige, Digitisation and data processing in Fourier transform NMR, Prog. NMR Spectrosc. 14, 27-66 (1980).
22. G. A. Morris, Compensation of instrumental imperfections by deconvolution using an internal reference signal, J. Magn. Reson. 80, 547 (1988).
23. A. Gibbs and G. A. Morris, Reference deconvolution. Elimination of distortions arising from reference line truncation, J. Magn. Reson. 91, 77-83 (1991).
24. P. J. Hore, Solvent suppression in Fourier transform nuclear magnetic resonance, J. Magn. Reson. 55, 283-300 (1983).
25. D. Marion and A. Bax, Baseline correction of 2D FT NMR spectra using a simple linear prediction extrapolation of the time-domain data, J. Magn. Reson. 83, 205-211 (1989).
26. V. A. Mandelshtam, T. R. Ravuri, and H. S. Taylor, Calculation of the density of resonance states using the stabilization method, Phys. Rev. Lett. 70, 1932-1935 (1993).
27. R. R. Ernst, G. Bodenhausen, and A. Wokaun, "Principles of Nuclear Magnetic Resonance in One and Two Dimensions," Clarendon Press, Oxford (1987).