Density functional predicted geometries and vibrational frequencies of the neutral and anion-radical form of pheophytin: Relevance to electron transfer in photosynthetic reaction centres

Chemical Physics Letters

Volumn 331, Issue 1, 2000, Pages 78-82

  O'Malley, Patrick J ^a  

^a UNIVERSITY OF MANCHESTER   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0011194875     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0009-2614(00)01146-5     Document Type: Article

References (15)

1. J. Deisenhofer, J.R. Norris, The Photosynthetic Reaction Center, vols. 1 and 2, Academic Press, New York, 1993.
2. Forman A., Davis M.S., Fujita I., Hanson L.K., Smith K.M., Fajer J. Isr. J. Chem. 21:1981;265.
3. Mantele W.G., Wollenweber A.M., Nabedryk E., Breton J. Proc. Natl. Acad. Sci. USA. 85:1988;8468.
4. Naberryk E., Andrianambnintsoa S., Berger G., Leonhard M., Mantele W., Breton J. Biochim. Biophys. Acta. 1016:1990;49.
5. Lubitz W., Isaacson R.A., Okamura M.Y., Abresch E.C., Plato M., Feher G. Biochim. Biophys. Acta. 977:1989;227.
6. Ermler U., Fritzsch G., Buchanan S.K., Michel H. Structure. 2:1994;925.
7. V. Barone, D.P. Chong, Recent Advances in Density Functional Methods, World Scientific, Singapore, 1995.
8. O'Malley P.J., Collins S.J. Chem. Phys. Lett. 259:1996;296.
9. Suter H.U, Nonella M. J. Phys. Chem. A102:1998;10128.
10. Himo F., Grasslund A., Eriksson L.A. Biophys. J. 72:1997;1556.
11. Bloomberg M.R.A., Siegbahn P.E.M., Babcock G.T. J. Amer. Chem. Soc. 120:1998;8812.
12. M.J. Frisch et al., GAUSSIAN98, Gaussian Inc., Pittsburgh, PA, 1998.
13. O'Malley P.J. J. Phys. Chem. B. 104:2000;2176.
14. O'Malley P.J. J. Comput. Chem. 20:1999;1292.
15. O'Malley P.J. J. Am. Chem. Soc. 121:1999;3185.