Abstract
We consider here the theoretical and quantum chemical description of the photoexcitated states in DNA duplexes. We discuss the motivation and limitations of an exciton model and use this as the starting point for more detailed excited state quantum chemical evaluations. In particular, we focus upon the role of interbase proton transfer between Watson/Crick pairs in localizing an excitation and then quenching it through intersystem crossing and charge transfer.
Access this chapter
Tax calculation will be finalised at checkout
Purchases are for personal use only
Preview
Unable to display preview. Download preview PDF.
References
Kelley, S. O.; Barton, J. K. Science 1999, 283, 375.
Crespo-Hernandez, C. E.; Cohen, B.; Kohler, B. Nature 2005, 436, 1141.
Markovitsi, D.; Onidas, D.; Gustovsson, T.; Talbot, F.; Lazzarotto, E. J. Am. Chem. Soc. 2005, 127, 17130.
Markovitsi, D.; Talbot, F.; Gustavsson, T.; Onidas, D.; Lazzarotto, E.; Marguet, S. Nature 2006, 441, E7.
Besaratinia, A.; Synold, T. W.; Chen, H.-H.; Chang, C.; Xi, B.; Riggs, A. Proc Natl Acad Sci U S A 2005, 102(29), 10058.
Sutherland, B. M.; Oliver, R.; Fuselier, C. O.; Sutherland, J. C. Biochem. 1976, 15(2), 402.
Callis, P. R. Chem. Phys. Lett. 1979, 61, 563-567.
Sinha, R. P.; Hädler, D.-P. Photochem. Photobiol. Sci. 2002, 1, 225-236.
Freeman, S. E.; Hacham, H.; Gange, R. W.; Maytum, D. J.; Sutherland, J. C.; Sutherland, B. M. Proc Natl Acad Sci U S A 1989, 86, 5605-5609.
Mouret, S.; Baudouin, C.; Charveron, M.; Favier, A.; Cadet, J.; Douki, T. Proc Natl Acad Sci U S A 2006, 103(37), 13765.
Löwdin, P. O. Rev. Mod. Phys. 1963, 35, 724.
Schultz, T.; Samoylova, E.; Radloff, W.; Ingolf, V. H.; Sobolewski, A. L.; Domcke, W. Science 2004, 306, 1765-8.
Emanuele, E.; Markovitsi, D.; Millie, P.; Zakrzewska, K. ChemPhysChem 2005, 6, 1387-1393.
Crespo-Hernandez, C. E.; Cohen, B.; Kohler, B. Nature 2006, 441, E8.
Pecourt, J.-M.; Peon, J.; Kohler, B. J. Am. Chem. Soc. 2001, 123.
Pecourt, J.-M.; Peon, J.; Kohler, B. J. Am. Chem. Soc. 2000, 122.
Gustavsson, T.; Sharonov, A.; Markovitsi, D. Chemical Physics Letters 2002, 351(3-4), 195-200.
Peon, J.; Zewail, A. H. Chemical Physics Letters 2001, 348(3-4), 255-262.
Douhal, A.; Kim, S. K.; Zewail, A. H. Nature 1995, 378, 260.
Shapiro, S. L.; Campillo, A. J.; Kollman, V. H.; Goad, W. B. Optics Communications 1975, 15, 308-10.
Suhai, S. International Journal of Quantum Chemistry, Quantum Biology Symposium 1984, 11, 223-35.
Krueger, B. P.; Scholes, G. D.; Fleming, G. R. J. Phys. Chem. B 1998, 102, 5378.
Czader, A.; Bittner, E. R. The Journal of Chemical Physics 2008, 128(3), 035101.
Brédas, J.-L.; Cornil, J.; Heeger, A. J. May 1996, 8(5), 447-452.
Karabunarliev, S.; Bittner, E. R. Aug 2003, 119(7), 3988-3995.
Karabunarliev, S.; Bittner, E. R. Physical Review Letters 2003, 90(5), 057402.
Santoro, F.; Barone, V.; Improta, R. Proc Natl Acad Sci U S A 2007, 104(24), 9931-9936.
McCammon, J. A.; Harvey, S. C. Dynamics of proteins and nucleic acids; Cambridge University Press: Cambridge, 2nd ed., 1987.
Bouvier, B.; Gustavsson, T.; Markovitsi, D.; Millie, P. Chemical Physics 2002, 275, 75-92.
Bittner, E. R. The Journal of Chemical Physics 2006, 125(9), 094909.
Villani, G. Chemical Physics 2005, 316, 1-8.
Gorb, L.; Podolyan, Y.; Dziekonski, P.; Sokalski, W. A.; Leszczynski, J. J. AM. CHEM. SOC. 2004, 126, 10119-10129.
Guallar, V.; Douhal, A.; Moreno, M.; Lluch, J. M. J. Phys. Chem. A 1999, 103, 6251-6256.
Perun, S.; Sobolewski, A. L.; Domcke, W. J. Phys. Chem. A 2006, 110, 9031-9038.
Lu, X.-J.; Olson, W. K. Nucleic Acids Research 2003, 31(17), 5108-5121.
Author information
Authors and Affiliations
Corresponding author
Editor information
Editors and Affiliations
Rights and permissions
Copyright information
© 2009 Springer-Verlag Berlin Heidelberg
About this chapter
Cite this chapter
Bittner, E.R., Czader, A. (2009). Quantum Mechanics in Biology: Photoexcitations in DNA. In: Burghardt, I., May, V., Micha, D., Bittner, E. (eds) Energy Transfer Dynamics in Biomaterial Systems. Springer Series in Chemical Physics, vol 93. Springer, Berlin, Heidelberg. https://doi.org/10.1007/978-3-642-02306-4_4
Download citation
DOI: https://doi.org/10.1007/978-3-642-02306-4_4
Published:
Publisher Name: Springer, Berlin, Heidelberg
Print ISBN: 978-3-642-02305-7
Online ISBN: 978-3-642-02306-4
eBook Packages: Chemistry and Materials ScienceChemistry and Material Science (R0)