Monte Carlo simulations study for solvent effect on Cs+ to Rb+ ion mutation

Chemical Physics Letters

Volumn 321, Issue 3-4, 2000, Pages 262-268

  Kim, Hag Sung ^a  

^a Ulsan College   (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000335264     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(00)00336-5     Document Type: Article

References (41)

1. Choi H.S., Suh S.B., Cho S.J., Kim K.S. Proc. Natl. Acad. Sci. USA. 95:1998;12094.
2. Kumpf R.A., Dougherty D.A. Science. 261:1993;1708.
3. Cui C., Kim K.S. J. Phys. Chem. A. 103:1999;2751.
4. Michaux G., Reisse J. J. Am. Chem. Soc. 104:1982;6895.
5. J.P. Valleau, G.M. Torrie, in: B.J. Berne (Ed.), Statistical Mechanics, Part A, Plenum, New York, 1977, p. 169.
6. Jorgensen W.L. J. Phys. Chem. 87:1983;5304.
7. Rebertus D.W., Berne B.J., Chandler D. J. Chem. Phys. 70:1979;3395.
8. Mezei M., Mehrotra P.K., Beveridge D.L. J. Am. Chem. Sec. 107:1985;2239.
9. Chandrasekhar J., Jorgensen W.L. J. Am. Chem. Soc. 107:1985;2974.
10. Postma J.P.M., Berendsen H.J.C., Haak J.R. Faraday Symp. Chem. Soc. 17:1982;55.
11. Tembe B.L., McCammon J.A. Comput. Chem. 8:1984;281.
12. Kollman P.A. Chem. Rev. 93:1993;2395.
13. Leo A., Hansch C., Elkins D. Chem. Rev. 71:1971;525.
14. C. Hansch, A. Leo, Substituent Constants for Correlation Analysis in Chemistry and Biology, Wiley, New York, 1979.
15. W.J. Dunn III, J.S. Block, R.S. Pearlman (Eds.), Partition Coefficient, Determination and Estimation, Pergamon, New York, 1986.
16. Dunn W.J. III, Koehler M.G., Grigoras S. J. Med. Chem. 30:1987;1121.
17. Klopman G., Namboodiri K., Schochet M. J. Comput. Chem. 6:1985;28.
18. W.L. Jorgensen, BOSS Version 3.8, Yale University, New Haven, CT, 1997.
19. Jorgensen W.L., Ravimohan C. J. Chem. Phys. 83:1985;3050.
20. Jorgensen W.L., Briggs J.M. J. Am. Chem. Soc. 111:1989;4120.
21. Zwanzig R.W. J. Chem. Phys. 22:1954;1420.
22. Jorgensen W.L. Acc. Chem. Res. 22:1989;184.
23. Cieplak P., Kollman P.A. J. Am. Chem. Soc. 110:1988;3714.
24. Jorgensen W.L., Blake J.F., Buckner J.K. Chem. Phys. 129:1989;193.
25. Jorgensen W.L. J. Phys. Chem. 90:1986;6379.
26. Jorgensen W.L., Tirado-Rives J. Am. Chem. Soc. 110:1988;1657.
27. R.J.l. Abraham, E. Bretschneider. in: W.J. Orville-Thomas (Ed.), Internal Rotation in Molecules, Wiley, London, 1974, Chap. 13.
28. Jorgensen W.L., Briggs J.M., Contreras M.L. J. Phys. Chem. 94:1990;1683.
29. Åqvist J. J. Phys. Chem. 94:1990;8021.
30. Izatt R.M., Bradshow J.S., Nielsen S.A., Lamb J.D., Christensen J.J. Chem. Rev. 85:1985;271.
31. Mezei M., Beveridge D.L. J. Chem. Phys. 74:1981;6902.
32. GAUSSIAN 98, User's Reference 1998, p. 162.
33. Handbook of Chemistry and Physics, 71st edn., CRC Press, 1990.
34. J. Burgress, in: Metal Ions in Solution, Halsted Press, Chap. 1, 1978, p. 32.
35. K. Heizinger, P.C. Vogel, Z. Naturforsh. A 31 (1976) 463.
36. P.C. Vogel, K. Heizinger, Z. Naturforsh. A 31 (1976) 476.
37. G. Palinkas, W.O. Riede, K. Heizinger, Z. Naturforsh. A 32 (1977) 1137.
38. P. Bopp. W. Dietz, K. Heizinger, Z. Naturforsh. A 34 (1979) 1424.
39. G. Szasc, K. Heizinger, Z. Naturforsh. A 34 (1979) 840.
40. S.H. Lee, J.C. Rasaiah, J. Phys. Chem. 100 (1996) 1420.
41. Y. Marcus, in: Ion Solvation, Wiley, Chap. 5, 1985, p. 117.