Experimental configurational landscapes in aqueous solutions

Philosophical Transactions of the Royal Society A: Mathematical, Physical and Engineering Sciences

Volumn 363, Issue 1827, 2005, Pages 469-492

  Finney, John L ^a   Bowron, Daniel T ^b   Wolynes, P G ^c   Barnes, P ^d   Karplus, M ^e   McMillan, P F ^a   Fernandez Alonso, F ^f   Angell, C A ^g  

^a UNIVERSITY COLLEGE LONDON   (United Kingdom)

^b RUTHERFORD APPLETON LABORATORY   (United Kingdom)

^c UNIVERSITY OF CALIFORNIA   (United States)

^d UNIVERSITY OF LONDON   (United Kingdom)

^e UNIVERSITÉ LOUIS PASTEUR   (France)

^f RUTHERFORD APPLETON LABORATORY   (United Kingdom)

^g ARIZONA STATE UNIVERSITY   (United States)

Author keywords

Amphiphiles; Aqueous solutions; Concentration dependence; Potential of mean force; Salting out; Temperature dependence

Indexed keywords

EID: 12944257152     PISSN: 1364503X     EISSN: None     Source Type: Journal    
DOI: 10.1098/rsta.2004.1503     Document Type: Article

References (32)

1. Armitage, D. A., Blandamer, M. J., Morcom, K. W. & Treloar, N. C. 1968 Partial molar volumes and maximum density effects in alcohol-water mixtures. Nature 219, 718-720.
2. Bowron, D. T. & Finney, J. L. 2003 Structure of a salt-amphiphile-water solution and the mechanism of salting out. J. Chem. Phys. 118, 8357-8372.
3. Bowron, D. T., Finney, J. L. & Soper, A. K. 1998a Structural investigation of solute-solute interactions in aqueous solutions of tertiary butanol. J. Phys. Chem. B 102, 3551-3563.
4. Bowron, D. T., Finney, J. L. & Soper, A. K. 1998b The structure of pure tertiary butanol. Mol. Phys. 93, 531-543.
5. Bowron, D. T., Soper, A. K. & Finney, J. L. 2001 Temperature dependence of the structure of a 0.06 mole fraction tertiary butanol-water solution. J. Chem. Phys. 114, 6203-6219.
6. Buchner, R., Hefter, G. T. & May, P. M. 1999 Dielectric relaxation of aqueous NaCl solutions. J. Phys. Chem. A 103, 1-9.
7. Edwards, F. G., Enderby, J. E., Howe, R. A. & Page, D. I. 1975 The structure of molten sodium chloride. J. Phys.C 8, 3483-3490.
8. Egelstaff, P. A. 1994 An introduction to the liquid state. Oxford: Clarendon Press.
9. Enderby, J. E & Neilson, G. W. 1979 X-ray and neutron scattering by electrolytes. In Water: a comprehensive treatise (ed. F. Franks), vol. 6. pp. 1-46. New York: Plenum.
10. Franks, F. & Desnoyers, J. E. 1985 Alcohol-water mixtures revisited. Water Sci. Rev. 1, 171-232.
11. Frank, H. S. & Evans, M. W. 1945 Free volume and entropy in condensed systems. III. Entropy in binary liquid mixtures; partial molal entropy in dilute solutions; structure and thermo-dynamics in aqueous electrolytes. J. Chem. Phys. 13, 507-532.
12. Hansen, J. P. & McDonald, I. R. 1986 Theory of simple liquids. London: Academic.
13. Hofmeister, F. 1888 About the science of the effect of salts (Zur Lehre von der Wirkung der Salze): about regularities in the protein precipitating effects of salts and the relation of these effects with the physiological behaviour of salts. Arch. Exp. Path. Pharmakol. 24, 247-260.
14. Holz, M., Grunder, R., Sacco, A. & Mcleleo, A. 1993 Nuclear magnetic resonance study of self-association of small hydrophobic solutes in water: salt effects and the lyotropic series. J. Chem. Soc. Farad. Trans. 89, 1215-1222.
15. Mahler, H. R. & Cordes, E. H. 1971 Biological chemistry. New York: Harper and Row.
16. Mayerle, M., Holz, M. & Sacco, M. 1999 NMR studies on hydrophobic interactions in solution. 4. Temperature and concentration dependence of the hydrophobic self-association of tert-butanol in water. Phys. Chem. Chem. Phys. 1, 4615-4618.
17. Nortmann, K., Hilland, J. & Kaatze, U. 1997 Dielectric properties of aqueous NaCl solutions at microwave frequencies. J. Phys. Chem. A 101, 6864-6869.
18. Osakai, T., Ogata, A. &; Ebina, K. 1997 Hydration of ions in organic solvent and its significance in the Gibbs energy of ion transfer between two immiscible liquids. J. Phys. Chem. B 101, 8341-8348.
19. Pratt, L. R. & Chandler, D. 1977 Theory of the hydrophobic effect. J. Chem. Phys. 67, 3683-3704.
20. + in liquid water. Fluid Phase Equil. 183, 121-132.
21. Sacco, A., De Cillis, F. M. & Holz, M. 1998 NMR studies on hydrophobic interactions in solution. 3. Salt effects on the self-association of ethanol in water at two different temperatures. J. Chem. Soc. Farad. Trans. 94, 2089-2092.
22. Skipper, N. T., Bridgeman, C. H., Buckingham, A. D. & Mancera, R. L. 1996 Computer simulation studies of the hydration and aggregation of simple hydrophobic molecules. Faraday Discuss. 103, 141-150.
23. Soper, A. K. 1996 Empirical potential Monte Carlo simulation of fluid structure. Chem. Phys. 202, 295-306.
24. Soper, A. K., Howells, W. S. & Hannon, A. C. 1989 ATLAS: analysis of time-of-flight diffraction data from liquid and amorphous samples. Rutherford Appleton Laboratory, report no. RAL-89-046.
25. Urry, D. W. 1993 Molecular machines: how motion and other functions of living organisms can result from reversible chemical changes. Angew. Chem. Int. Ed. 32, 819-841.
26. Zasetsky, A. & Svishchev, I. M. 2001 Dielectric response of concentrated NaCl aqueous solutions: molecular dynamics simulations. J. Chem. Phys. 115, 1448-1454.
27. Zavitsas, A. 2001 Properties of water solutions of electrolytes and nonelectrolytes. J. Phys. Chem. B 105, 7805-7817.
28. Berendsen, H. J. C., Grigera, J. R. & Straatsma, T. P. 1987 J. Phys. Chem. 91, 6269.
29. Jorgensen, W. L., Madura, J. D. & Swenson, C. J. 1984 J. Am. Chem. Soc. 106, 6638.
30. Jorgensen, W. L. 1986 J. Phys. Chem. 90, 1276.
31. Soper, A. K. 2001 Molec. Phys. 99, 1503.
32. Zowail, A. H. 2005 Phil. Trans. R. Soc. Lond. A 363, 315-329.