Electronic description of four flavonoids revisited by DFT method

Journal of Molecular Structure: THEOCHEM

Volumn 856, Issue 1-3, 2008, Pages 38-45

  Antonczak, Serge ^a  

^a UNIVERSITÉ CÔTE D'AZUR   (France)

Author keywords

B3LYP; Catechin; Flavonoids; Luteolin; Quercetin; Taxifolin

Indexed keywords

EID: 42149135365     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.01.014     Document Type: Article

References (36)

1. Peterson J., and Dwyer J. Nutr. Res. 18 (1998) 1995
2. Havsteen B.H. Pharmacol. Ther. 96 (2002) 67
3. Di Carlo G., Mascolo N., Izzo A.A., and Capasso F. Life Sci. 65 (1999) 337
4. Cotelle N. Curr. Top. Med. Chem. 1 (2001) 569
5. Jovanovic S.V., Steenken S., Tosic M., Marjanovic B., and Simic M.G. J. Am. Chem. Soc. 116 (1994) 4846
6. Nagao A., Seki M., and Kobayashi H. Biosci., Biotechnol., Biochem. 63 (1999) 1787
7. Cao G., Sofic E., and Prior R.L. Free Radic. Biol. Med. 22 (1997) 749
8. Yamashita N., Tanemura H., and Kawanishi S. Mutat. Res. 425 (1999) 107
9. Lin C.-M., Chen C.-S., Chen C.-T., Liang Y.-C., and Lin J.-K. Biochem. Biophys. Res. Commun. 294 (2002) 167
10. Harris S.R., and Thorgeirsson U.P. Biochem. Biophys. Res. Commun. 235 (1997) 509
11. Chiesi M., and Schwaller R. Biochem. Pharmacol. 49 (1995) 495
12. van Acker S.A.B.E., de Groot M.J., van den Berg D.-J., Tromp M.N.J.L., Donné-Op den Kelder G., van der Vijgh W.J.F., and Bast A. Chem. Res. Toxicol. 9 (1996) 1305
13. Russo N., Toscano M., and Uccella N. J. Agric. Food Chem. 48 (2000) 3232
14. Leopoldini M., Marino T., Russo N., and Toscano M. Theor. Chem. Acc. 111 (2004) 210
15. Vasilescu D., and Girma R. Int. J. Quantum Chem. 90 (2002) 888
16. Fiorucci S., Golebiowski J., Cabrol-Bass D., and Antonczak S. J. Agric. Food Chem. 55 (2007) 903
17. Fiorucci S., Golebiowski J., Cabrol-Bass D., and Antonczak S. ChemPhysChem 5 (2004) 1726
18. Cornard J.P., Merlin M.J., Boudet A.C., and Vrielynck L. Biospectroscopy 3 (1997) 183
19. Trouillas P., Fagnère C., Lazzaroni R., Calliste C., Marfak A., and Duroux J.-L. Food Chem. 88 (2004) 571
20. Trouillas P., Marsal P., Siri D., Lazzaroni R., and Duroux J.-L. Food Chem. 97 (2006) 679
21. Redrejo-Rodriguez M., Tejeda-Cano A., del Carmen Pinto M., and Macías P. J. Mol. Struct. (Theochem) 674 (2004) 121
22. Gaussian 98, Revision A.7, M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zakrzewski, J.A. Montgomery, Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudin, M.C. Strain, O. Farkas, J. Tomasi, V. Barone, M. Cossi, R. Cammi, B. Mennucci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J. Cioslowski, J.V. Ortiz, A.G. Baboul, B.B.Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R. Gomperts, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, C. Gonzalez, M. Challacombe, P.M.W. Gill, B. Johnson, W. Chen, M.W. Wong, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, Gaussian, Inc., Pittsburgh, PA, 1998.
23. Becke A.D. J. Chem. Phys. 98 (1993) 5648
24. Becke A.D. J. Chem. Phys. 98 (1993) 8822
25. Lee C., Yang W., and Parr R.G. Phys. Rev. B 54 (1988) 785
26. Hariharan P.C., and Pople J.A. Theor. Chim. Acta 28 (1973) 213
27. Clark T., Chandrasekhar J., and Schleyer P.v.R. J. Comput. Chem. 4 (1983) 294
28. Krishnam R., Binkley J.S., Seeger R., and Pople J.A. J. Chem. Phys. 72 (1980) 650
29. Gill P.M.W., Johnson B.G., Pople J.A., and Frisch M.J. Chem. Phys. Lett. 197 (1985) 499
30. Hehre W.J., Radom L., Schleyer P.v.R., and Pople J.A. Ab Initio Molecular Orbital Theory (1986), Wiley, J. & Sons, New York
31. Reed A.E., Curtis L.A., and Weinhold F. Chem. Rev. 88 (1988) 899
32. Steiner R.A., Kalk K.H., and Dijkstra B. W. Proc. Natl. Acad. Sci. 9 (2002) 16625
33. Borbulevych O.Y., Jankun J., Selman S.H., and Skrzypczak-Jankum E. Proteins 54 (2004) 13
34. Martins H.F.P., Leal J.P., Fernandez M.T., Lopes V.H.C., and Cordeiro M.N.D.S. J. Am. Soc. Mass Spectrom. 15 (2004) 848
35. Leopoldini M., Russo N., and Toscano M. J. Agric. Food Chem. 54 (2004) 3078
36. Fiorucci S., Golebiowski J., Cabrol-Bass D., and Antonczak S. Proteins 64 (2006) 845