Structure and dynamics of water surrounding the poly(methacrylic acid): A molecular dynamics study

Journal of Chemical Physics

Volumn 126, Issue 22, 2007, Pages

  Ju, Shin Pon ^a,b   Lee, Wen Jay ^d   Huang, Ching I ^c   Cheng, Wei Zen ^c   Chung, Yong Ting ^c  

^a NATIONAL SUN YAT SEN UNIVERSITY   (Taiwan)

^b NATIONAL SUN YAT SEN UNIVERSITY   (Taiwan)

^c NATIONAL TAIWAN UNIVERSITY   (Taiwan)

^d NONE

Author keywords

[No Author keywords available]

Indexed keywords

CHARGE DENSITY; CONFORMATIONS; HYDROGEN BONDS; MOLECULAR DYNAMICS; MONOMERS; ORGANIC ACIDS; SOLUTIONS;

CHAIN CONFORMATION BEHAVIORS; POLYMETHACRYLIC ACIDS; RADIAL DISTRIBUTION FUNCTIONS;

WATER;

HYDROGEN; METHACRYLIC ACID; METHACRYLIC ACID DERIVATIVE; OXYGEN; WATER;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; COMPUTER SIMULATION; CONFORMATION; HYDROGEN BOND; THERMODYNAMICS;

COMPUTER SIMULATION; HYDROGEN; HYDROGEN BONDING; METHACRYLATES; MODELS, MOLECULAR; MOLECULAR CONFORMATION; OXYGEN; THERMODYNAMICS; WATER;

EID: 34250726000     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.2743963     Document Type: Article

References (55)

1. Handbook of Polyelectrolytes and Their Applications, edited by, S. K. Tripathy, J. Kumar, and, H. S. Nalwa, (American Scientific, Stevenson Ranch, CA, 2002), Vol. 3.
2. S. Hellebust, S. Nilsson, and A. M. Blokhus, Macromolecules 36, 5372 (2003).
3. M. Olvera de la Cruz, L. Belloni, M. Delsanti, J. P. Dalbiez, O. Spalla, and M. Drifford, J. Chem. Phys. 103, 5781 (1995).
4. F. Muller, P. Guenoun, M. Delsanti, B. Deḿ, L. Auvray, J. Yang, and J. W. Mays, Eur. Phys. J. E 15, 465 (2004).
5. R. D. Wesley, C. A. Dreiss, T. Cosgrove, S. P. Armes, L. Thompson, F. L. Baines, and N. C. Billingham, Langmuir 21, 4856 (2005).
6. P. Ravi, C. Wang, K. C. Tam, and L. H. Gan, Macromolecules 36, 173 (2003).
7. V. Sfica and C. Tsitsilianis, Macromolecules 36, 4983 (2003).
8. C. Wang, P. Ravi, K. C. Tam, and L. H. Gan, J. Phys. Chem. B 108, 1621 (2004).
9. H. Schiessel and P. Pincus, Macromolecules 21, 7953 (1988).
10. J. Wittner, A. Johner, and J. F. Joanny, J. Phys. II 5, 635 (1995).
11. P. Gonzalez-Mozuelos and M. Olvera de la Cruz, J. Chem. Phys. 103, 3145 (1995).
12. E. Raspaud, M. Olvera de la Cruz, J. L. Sikorav, and F. Livolant, Biophys. J. 74, 381 (1998).
13. N. V. Brilliantov, D. V. Kuznetsov, and R. Klein, Phys. Rev. Lett. 81, 1433 (1998).
14. E. Raspaud, I. Chaperon, A. Leforestier, and F. Livolant, Biophys. J. 77, 1547 (1999).
15. M. Muthukumar and G. Carri, J. Chem. Phys. 111, 1765 (1999).
16. T. T. Nguyen, I. Rouzina, and B. I. Shklovskii, J. Chem. Phys. 112, 2562 (2000).
17. F. J. Solis and M. Olvera de la Cruz, J. Chem. Phys. 112, 2030 (2000).
18. F. J. Solis and M. Olvera de la Cruz, Eur. Phys. J. E 4, 143 (2001).
19. F. J. Solis, J. Chem. Phys. 117, 9009 (2002).
20. P. Y. Hsiao and E. Luijten, Phys. Rev. Lett. 97, 148301 (2006).
21. M. J. Stevens and K. Kremer, J. Chem. Phys. 103, 1669 (1995).
22. M. J. Stevens and S. J. Plimpton, Eur. Phys. J. B 2, 341 (1998).
23. R. G. Winkler, M. Gold, and P. Reineker, Phys. Rev. Lett. 80, 3731 (1998).
24. U. Micka, C. Holm, and K. Kremer, Langmuir 15, 4033 (1999).
25. M. J. Stevens, Biophys. J. 80, 130 (2001).
26. R. G. Winkler, M. O. Steinhauser, and P. Reineker, Phys. Rev. E 66, 021802 (2002).
27. R. Messina, C. Holm, and K. Kremer, J. Chem. Phys. 117, 2947 (2002).
28. H. J. Limbach and C. Holm, J. Phys. Chem. B 107, 8041 (2003).
29. S. Liu, K. Ghosh, and M. Muthukumar, J. Chem. Phys. 119, 1813 (2003).
30. P. G. Khalatur, A. R. Khokhlov, D. A. Mologin, and P. Reineker, J. Chem. Phys. 119, 1232 (2003).
31. K. A. T. Silverstein, A. D. J. Haymet, and K. A. Dill, J. Am. Chem. Soc. 122, 8037 (2000).
32. S. Moelbert, B. Normand, and P. De Los Rios, Phys. Rev. E 69, 061924 (2004).
33. F. J. Solis, R. Weiss-Malik, and B. Vernon, Macromolecules 38, 4456 (2005).
34. D. A. C. Beck, D. O. V. Alonso, and V. Daggett, Biophys. Chem. 100, 221 (2003).
35. J. Dudowicz, K. F. Freed, and M. Y. Shen, J. Chem. Phys. 118, 1989 (2003).
36. S. S. Jang, V. Molinero, T. Caǧin, and W. A. Goddard III, J. Phys. Chem. B 108, 3149 (2004).
37. S. S. Jang, S. T. Lin, T. Caǧin, V. Molinero, and W. A. Goddard III, J. Phys. Chem. B 109, 10154 (2005).
38. S. T. Lin, P. K. Maiti, and W. A. Goddard III, J. Phys. Chem. B 109, 8663 (2005).
39. H. Morawetz and Y. Wang, Macromolecules 20, 194 (1987).
40. J. Zhang and N. A. Peppas, Macromolecules 33, 102 (2000).
41. S. V. Kazakov, V. I. Muronetz, M. B. Dainiak, V. A. Izumrudov, I. Y. Galaev, and B. Mattiasson, Macromol. Biosci. 1, 157 (2001).
42. P. Ravi, C. Wang, K. C. Tam, and L. H. Gan, Macromolecules 36, 173 (2003).
43. C. Wang, P. Ravi, K. C. Tam, and L. H. Gan, J. Phys. Chem. B 108, 1621 (2004).
44. J. Yao, P. Ravi, K. C. Tam, and L. H. Gan, Polymer 45, 2781 (2004).
45. M. Levitt, M. Hirshberg, R. Sharon, and V. Daggett, Comput. Phys. Commun. 91, 215 (1995).
46. M. Levitt, M. Hirshberg, R. Sharon, K. E. Laiding, and V. Daggett, J. Phys. Chem. B 101, 5051 (1997).
47. J. M. Haile, Molecular Dynamics Simulation (Wiley-Interscience, New York, 1992).
48. D. C. Rapaport, The Art of Molecular Dynamics Simulations (Cambridge University Press, Cambridge, 1997).
49. M. Praprotnik and D. Janežič, J. Chem. Phys. 122, 174103 (2005).
50. J. Martí, J. A. Padro, and E. Guárdia, J. Chem. Phys. 105, 639 (1996).
51. A. Chandra and T. Ichiye, J. Chem. Phys. 111, 2701 (1999).
52. N. Choudhury and B. M. Pettitt, J. Phys. Chem. B 109, 6422 (2005).
53. Z. Zhou, B. D. Todd, K. P. Travis, and R. J. Sadus, J. Chem. Phys. 123, 054505 (2005).
54. J. A. Padro, J. Marti, and E. Guardia, J. Phys.: Condens. Matter 6, 2283 (1994).
55. G. E. Walrafen, M. S. Hokmabadi, W. H. Yang, and Y. C. Chu, J. Phys. Chem. 93, 2909 (1989).