DNA Mutations Induced by Proton and Charge Transfer in the Low-Lying Excited Singlet Electronic States of the DNA Base Pairs: A Theoretical Insight

Journal of Physical Chemistry A

Volumn 103, Issue 31, 1999, Pages 6251-6256

  Guallar, Víctor ^a   Douhal, Abderrazzak ^b   Moreno, Miquel ^a   Lluch, José M ^a  

^a UNIVERSITAT AUTÒNOMA DE BARCELONA   (Spain)

^b Facultad de Ciencias del Medio Ambiente   (Spain)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0000742858     PISSN: 10895639     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp9908496     Document Type: Article

References (44)

1. Setlow, R. B. Proc. Natl. Acad. Sci. U.S.A. 1974, 71, 3363.
2. Kerr, R. A. Science 1998, 280, 202.
3. (b) Baird, C. Environmental Chemistry; W. H. Freeman and Co.: New York, 1995.
4. Darnell, J.; Lodish, H.; Baltimore, D. Molecular Cell Biology; Scientific American Books: New York, 1986; p 553
5. Taylor, J.-S. J. Chem. Educ. 1990, 67, 835 and references therein.
6. Watson, J. D.; Crick, F. H. C. Nature 1953, 171, 737, 964.
7. Löwdin, P.-O. Adv. Quantum Chem. 1965, 2, 213.
8. (b) Löwdin, P.O. Rev. Mod. Phys. 1963, 55, 724.
9. Scheiner, S.; Kern, C. W. J. Am. Chem. Soc. 1979, 101, 4081.
10. (b) Scheiner, S.; Kern, C. W. Chem. Phys. Lett. 1978, 57, 331.
11. Kong, Y. S.; Jhon, M. S.; Löwdin, P.-O. Int. J. Quantum Chem., Quantum Biol. Symp. 1987, 14, 189.
12. Hrouda, H.; Florián, J.; Hobza, P. J. Phys. Chem. 1993, 97, 1542.
13. (b) Florián, J.; Hrouda, V.; Hobza, P. J. Am. Chem. Soc. 1994, 116, 1457.
14. Florián, J.; Leszczynski, J. Mol. Phys. 1995, 84, 469.
15. (b) Florián, J.; Leszczynski, J. J. Am. Chem. Soc. 1996, 118, 3010.
16. Bertrán, J.; Oliva, A.; Rodríguez-Santiago, L.; Sodupe, M. J. Am. Chem. Soc. 1998, 120, 8159.
17. Ditchfield, R.; Hehre, W. J.; Pople, J. A. J. Chem. Phys. 1971, 54, 724; 1972, 56, 2257.
18. Ditchfield, R.; Hehre, W. J.; Pople, J. A. J. Chem. Phys. 1971, 54, 724; 1972, 56, 2257.
19. (b) Hariharan, P. C.; Pople, J. A. Theor. Chim. Acta 1973, 28, 213.
20. Hariharan, P. C.; Pople, J. A. Mol. Phys. 1974, 27, 209.
21. Gordon, M. S. Chem. Phys. Lett. 1980, 76, 163.
22. Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman, J. R.; Keith, T. A.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andrés, J. L.; Replogle, E. S.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; Defrees, D. J.; Baker, J.; Stewart, J. P.; Head- Gordon, M.; Gonzalez, C.; Pople, J. A. Gaussian 94; Gaussian, Inc.: Pittsburgh, PA, 1995
23. Foresman, J. B.; Head-Gordon, M.; Pople, J. A.; Frisch, M. J. J. Phys. Chem. 1992, 96, 135.
24. Peng, C.; Ayala, P. Y.; Schlegel, H. B.; Frisch, M. J. J. Comput. Chem. 1996, 17, 49.
25. Luth, K.; Scheiner, S. J. Phys. Chem. 1994, 98, 3582.
26. (b) Hrouda, V.; Florián, J.; Polasek, M.; Hobza, P. J. Phys. Chem. 1994, 98, 4742.
27. Paz, J. J.; Moreno, M.; Lluch, J. M. J. Chem. Phys. 1995, 103, 353.
28. Schlegel, H. B.; Binkley, J. S.; Pople, J. A. J. Chem. Phys. 1984, 80, 1976.
29. Hammond, G. S. J. Am. Chem. Soc. 1955, 77, 334.
30. Lias, S. G.; Liebmann, J. F.; Levine, R. D. J. Phys. Chem. Ref. Data 1984, 13, 695.
31. (b) Meot-Ner, M. J. Am. Chem. Soc. 1979, 101, 2396.
32. Colson, A. O.; Besler, B.; Sevilla, M. D. J. Phys. Chem. 1993, 97, 8092.
33. (b) Sevilla, M. D.; Besler, B.; Colson, A. O. J. Phys. Chem. 1995, 99, 1060.
34. Colominas, C.; Luque, F. J.; Orozco, M. J. Am. Chem. Soc. 1996, 118, 6811.
35. Greco, F.; Liguori, A.; Sindona, G.; Ucella, N. J. Am. Chem. Soc. 1990, 112, 9092.
36. Warshel, A.; Aqvist, J.; Creighton, S. Proc Natl. Acad. Sci. U.S.A. 1989, 86, 5820.
37. Zewail, A. H. Femtochemistry-Ultrafast Dynamics of the Chemical Bond; World Scientific: Singapore, 1994 and references therein.
38. Goodman, M. F. Nature 1995, 378, 237 and references therein.
39. Douhal, A.; Kim, S. K.; Zewail, A. H. Nature 1995, 378, 260.
40. (b) Lopez-Martens, R.; Long, P.; Solgadi, D.; Soep, B.; Syage, J.; Millie, Ph. Chem. Phys. Lett. 1997, 273, 219.
41. Takeuchi, S.; Tahara, T. Chem. Phys. Lett. 1997, 277, 340 J. Phys. Chem. A 1998, 102, 7740.
42. Takeuchi, S.; Tahara, T. Chem. Phys. Lett. 1997, 277, 340 J. Phys. Chem. A 1998, 102, 7740.
43. Chachisvilis, M.; Fiebig, T.; Douhal, A.; Zewail, A. H. J. Phys. Chem. A 1998, 102, 669.
44. (e) Folmer, D. E.; Puth, L.; Wisniewski, E. S.; Castelman, A. W., Jr. Chem. Phys. Lett. 1998, 287, 1.