NMR Relaxation Parameters in Molecules with Internal Motion: Exact Langevin Trajectory Results Compared with Simplified Relaxation Models

Journal of the American Chemical Society

Volumn 103, Issue 20, 1981, Pages 5998-6011

  Levy, Ronald M ^a   Karplus, Martin ^b   Wolynes, Peter G ^c  

^a HARVARD UNIVERSITY   (United States)

^b RUTGERS UNIVERSITY   (United States)

^c UNIVERSITY OF ILLINOIS AT URBANA CHAMPAIGN   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000459946     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja00410a002     Document Type: Article

References (46)

1. K. Kuhlman, D. Grant, and R. Harris, J. Chem. Phys., 52, 3439(1970).
2. J. R. Lyerla, Jr., and D. Grant, J. Phys. Chem., 76, 3213 (1972).
3. D. Bauer, G. Alms, J. Brauman, and R. Pécora, J. Chem. Phys., 61,2255 (1974).
4. J. R. Lyerla, Jr., and G. C. Levy, Top. Carbon-13 NMR Spectrosc.,1, 79 (1974).
5. J. Jonas in “Proceedings of the Nato ASI on High PressureChemistry”, Reidel, Dordrecht, 1978.
6. D. Doddrell and A. Allerhand, J. Am. Chem. Soc., 93, 1558 (1971).
7. T. M. Connor, Trans. Faraday Soc., 60, 1579 (1963).
8. J. Schaefer, Macromolecules, 6, 882 (1973).
9. Y. K. Levine, N. Birdsall, A. G. Lee, J. C. Metcalfe, P. Partington,and G. C. K. Roberts, J. Chem. Phys., 60, 2890 (1974).
10. J. R. Lyerla, Jr., H. M. McIntyre, and D. A. Torchia, Macromolecules,7, 11 (1974).
11. J. R. Lyerla, Jr., and T. T. Horikawa, J. Phys. Chem., 80, 1106(1976).
12. G. C. Levy, D. E. Axelson, R. Schwartz, and J. Hochmann, J. Am.Chem. Soc., 100, 410 (1978).
13. D. Canet, J. Brondeau, H. Nery, and J. P. Marchol, Chem. Phys.Lett., 72, 184 (1980).
14. A. G. Lee, N. J. M. Birdsall, J. C. Metcalfe, G. B. Warren, and G.C. K. Roberts, Proc. R. Soc. London, Ser. B. 193, 253 (1976).
15. P. Godici and F. Landsberger, Biochemistry, 14, 3927 (1975).
16. D. Bocian and S. Chan, Annu. Rev. Phys. Chem., 29, 307 (1978).
17. E. Oldfield, R. Norton, and A. Allerhand, Biochemistry, 250, 6368(1975).
18. E. Oldfield, R. Norton, and A. Allerhand, Biochemistry, 250, 6381(1975).
19. R. Visscher and F. R. N. Gurd, J. Biol. Chem., 250, 2238 (1975).
20. W. C. Jones, Jr., T. M. Rothgeb, and F. R. N. Gurd, J. Biol. Chem.,7452 (1976).
21. R. J. Wittebort, T. M. Rothgeb, A. Szabo, and F. R. N. Gurd, Proc.Natl. Acad. Sci. U.S.A., 76, 1059 (1979).
22. L. W. Jelinski and D. Torchia, J. Mol. Biol., 133, 45 (1979).
23. L. W. Jelinski and D. Torchia, J. Mol. Biol., 138, 255 (1980).
24. D. Wallach, J. Chem. Phys., 47, 3258 (1967).
25. R. J. Wittebort, A. Szabo, and F. R. N. Gurd, J. Am. Chem. Soc.,102, 5723 (1980).
26. R. J. Wittebort and A. Szabo, J. Chem. Phys., 69, 1722 (1978).
27. R. E. London and J. Avitable, J. Am. Chem. Soc., 100, 7159 (1978).
28. O. W. Howarth, Faraday Discuss. Chem. Soc., Part 2, 75, 863(1979).
29. R. E. London and J. Avitable, J. Am. Chem. Soc., 99, 7765 (1977).
30. A. Tsutsumi and C. Chachaty, Macromolecules, 12, 429 (1979).
31. J. P. Ryckaert and A. Bellemans, Faraday Discuss. Chem. Soc., 66,95 (1978).
32. J. H. Weiner and M. R. Pear, Macromolecules, 10, 317 (1977).
33. T. Weber, J. Chem. Phys., 70, 4277 (1979).
34. R. M. Levy, M. Karplus, and J. A. McCammon, Chem. Phys. Lett.,65, 4 (1979).
35. M. Fixman, J. Chem. Phys., 69, 1538 (1978).
36. E. Helfand, Z. R. Wasserman, and T. A. Weber, J. Chem. Phys., 70,2016 (1979).
37. G. T. Evans and D. C. Knauss, J. Chem. Phys., 71, 2255 (1979).
38. G. T. Evans and D. C. Knauss, J. Chem. Phys., 72, 1504 (1980).
39. J. A. Montgomery, S. L. Holmgren, and D. Chandler, J. Chem. Phys.,73, 3688 (1980).
40. D. Doddrell, V. Glushko, and A. Allerhand, J. Chem. Phys., 56, 3683(1972).
41. R. Zwanzig and N. Ailawadi, Phys. Rev., 182, 280 (1969).
42. S. Harvey, Biopolymers, 18, 1081 (1979).
43. D. C. Knauss, G. T. Evans, and D. M. Grant, Chem. Phys. Lett., 71, 158 (1980).
44. D. Edholm and C. Blomberg, Chem. Phys., 42, 449 (1979).
45. M. Elwenspoek, Mol. Phys., 37, 689 (1979).
46. A. Baram and W. M. Gelbart, J. Chem. Phys., 66, 617 (1977).