DFT studies of functionalized carbon nanotubes and fullerenes as nanovectors for drug delivery of antitubercular compounds

Chemical Physics Letters

Volumn 447, Issue 1-3, 2007, Pages 105-109

  Gallo, Marco ^a   Favila, Alejandra ^a   Glossman Mitnik, Daniel ^a  

^a PRINATEC   (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; DENSITY FUNCTIONAL THEORY; DRUG DELIVERY; FULLERENES; QUANTUM CHEMISTRY; SOLVATION;

ANTITUBERCULAR COMPOUNDS; ENERGIES OF SOLVATION; NANOVECTORS; QUANTUM-CHEMICAL MOLECULAR DESCRIPTORS;

CARBON NANOTUBES;

EID: 34848890901     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2007.08.098     Document Type: Article

References (19)

1. Favila A., Gallo M., and Glossman-Mitnik D. J. Mol. Mod. 13 (2007) 505
2. Scroeder E.K., de Souza O.N., Santos D.S., Blanchard J.S., and Basso L.A. Curr. Pharm. Biotech. 3 (2002) 197
3. Kostarelos K., et al. Nature 2 (2007) 108
4. Lacerda L., Bianco A., Prato M., and Kostarelos K. Adv. Drug Delivery Rev. 58 (2006) 1460
5. Klumpp C., Kostarelos K., Prato M., and Bianco A. Biochim. Biophys. Acta 1758 (2006) 404
6. U. Hartnagel, A. Hirsch, R. Lebovitz, US Pat. Appl. Publ., 2006, 37 pp., US Ser. No. 960,449, US 2006040938 A1 20060223 Patent written in English, Application: US 2005-256359 20051021.
7. Bianco A., Kostarelos K., Partidos C.D., and Prato M. Chem. Commun. 5 (2005) 571
8. Yang J., Wang K., Driver J., Yang J., and Barron A.R. Org. Biomol. Chem. 5 (2007) 260
9. Delley B. J. Chem. Phys. 92 (1990) 508
10. Delley B. J. Chem. Phys. 113 (2000) 7756
11. Perdew J.P., and Wang Y. Phys. Rev. B 45 (1992) 13244
12. Becke A.D.J. J. Chem. Phys. 98 (1993) 5648
13. Jensen F. Introduction to Computacional Chemistry. second edn. (2007), John Wiley and Sons, NJ, USA
14. Frisch M.J., et al. Gaussian 03, Revision C.02 (2004), Gaussian, Inc., Wallingford, CT
15. Veloso M.V., Souza Filho A.G., Mendes Filho J., Fagan S.B., and Mota R. Chem. Phys. Lett. 430 (2006) 71
16. Andzelm J., and Kolmel C. J. Chem. Phys. 103 (1995) 9312
17. Zhou Z., Steigerwald M., Hybertsen M., Brus L., and Friesner R. J. Am. Chem. Soc. 126 (2004) 3597
18. Shukla M.K., and Leszcynski J. Chem. Phys. Lett. 48 (2006) 317
19. Tenorio F.J., and Robles J. Int. J. Quantum Chem. 80 (2000) 220