Dielectric effects due to the environment on the structure and proton affinity of retinal Schiff base models

Chemical Physics Letters

Volumn 299, Issue 5, 1999, Pages 457-464

  Tajkhorshid, Emadeddin ^a   Suhai, Sándor ^a  

^a GERMAN CANCER RESEARCH CENTER DKFZ   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001478103     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(98)01313-X     Document Type: Article

References (25)

1. D. Oesterhelt, J. Tittor, E. Bamberg, J. Bioenerg. Biomembr. 24 (1992) 181.
2. R.A. Mathies, S.W. Lin, J.B. Ames, W.T. Pollard, Ann. Rev. Biophys. Biophys. Chem. 20 (1991) 491.
3. J.K. Lanyi, Biochim. Biophys. Acta 1183 (1993) 241.
4. G. Orlandi, K. Schulten, Chem. Phys. Lett. 64 (1979) 370.
5. P. Tavan, K. Schulten, D. Oesterhelt, Biophys. J. 47 (1985) 415.
6. A. Warshel, Photochem. Photobiol. 30 (1979) 285.
7. A. Warshel, Methods Enzymol. 127 (1986) 578.
8. T. Baasov, M. Sheves, Biochemistry 25 (1986) 5249.
9. I. Rousso, N. Friedman, M. Sheves, M. Ottolenghi, Biochemistry 34 (1995) 12059.
10. S. Druckman, M. Ottolenghi, A. Pande, J. Pande, R.H. Callender, Biochemistry 21 (1982) 4953.
11. M. Sheves, N. Friedman, A. Albeck, M. Ottolenghi, Proc. Natl. Acad. Sci. USA 83 (1986) 3262.
12. E. Tajkhorshid, B. Paizs, S. Suhai, J. Phys. Chem. B 101 (1997) 8021.
13. E. Tajkhorshid, B. Paizs, S. Suhai, (1998) submitted.
14. E. Tajkhorshid, S. Suhai, Theoret. Chem. Acc. (1998) in press.
15. E. Tajkhorshid, S. Suhai, (1998) submitted.
16. K. Schulten, P. Tavan, Nature 272 (1978) 85.
17. K. Schulten, W. Humphrey, I. Logunov, M. Sheves, D. Xu, Isr. J. Chem. 35 (1995) 447, and references therein.
18. A. Warshel, M.J. Levitt, J. Mol. Biol. 103 (1976) 227.
19. DMOL, version 960, Molecular Simulation, San Diego, CA, 1996.
20. J. Andzelm, J. Baker, A. Scheiner, M. Wrinn, Int. J. Quant. Chem. 56 (1995) 733.
21. A.D. Becke, Phys. Rev. A 38 (1988) 3098.
22. C. Lee, W. Yang, R.G. Parr, Phys. Rev. B 37 (1988) 785.
23. A. Klamt, G. Schürmann, J. Chem. Soc. Perkin Trans. 2 5 (1993) 799.
24. E. Tajkhorshid, K.J. Jalkanen, S. Suhai, J. Phys. Chem. B 102 (1998) 5899.
25. M.J. Frisch, G.W. Trucks, H.B. Schlegel, P.M.W. Gill, B.G. Johnson, M.A. Robb, J.R. Cheeseman, T. Keith, G.A. Peterson, J.V. Oritz, J.B. Foresman, J. Cioslowski, B.B. Stefanov, A. Nanayakkara, M. Challacombe, C.Y. Peng, P.Y. Ayala, W. Chen, M.W. Wong, J.L. Andres, E.S. Replogle, R. Gomperts, R.L. Martin, D.J. Fox, J.S. Binkley, D.J. Defrees, J. Baker, J.P. Stewart, M. Head-Gordon, C. Gonzales, J.A. Pople, GAUSSIAN94, Revision C.3, Gaussian, Pittsburg, PA, 1985.