Molecular dynamics properties of varying amounts of the anticancer drug gemcitabine inside an open-ended single-walled carbon nanotube

Chemical Physics Letters

Volumn 550, Issue , 2012, Pages 99-103

  Rungnim, Chompoonut ^a   Arsawang, Uthumporn ^a   Rungrotmongkol, Thanyada ^a   Hannongbua, Supot ^a  

^a CHULALONGKORN UNIVERSITY   (Thailand)

Author keywords

[No Author keywords available]

Indexed keywords

ANTICANCER DRUG; DRUG CONCENTRATION; DRUG MOLECULES; GEMCITABINE; MOLECULAR DYNAMICS SIMULATIONS; STACKING INTERACTION;

HYDROGEN BONDS; LOADING; MOLECULES; SINGLE-WALLED CARBON NANOTUBES (SWCN);

MOLECULAR DYNAMICS;

EID: 84867334328     PISSN: 00092614     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cplett.2012.08.050     Document Type: Article

References (32)

1. S. Iijima Nature 354 1991 56
2. T.A. Hilder, and J.M. Hill Small 5 2009 300
3. K. Ajima, M. Yudasaka, T. Murakami, A. Maigne, K. Shiba, and S. Ijima Mol. Pharm. 2 2005 475
4. Z. Liu Angew. Chem. Int. Edit. 48 2009 7668
5. E. Heister Carbon 47 2009 2152
6. C. Menard-Moyon, C. Fabbro, M. Prato, and A. Bianco Chem. Eur. J. 17 2011 3222
7. C. Klumpp, K. Kostarelos, M. Prato, and A. Bianco Biochim. Biophys. Acta, Biomembr. 1758 2006 404
8. Y. Zhang, Y. Bai, and B. Yan Drug Discov. Today 15 2010 428
9. T.A. Hilder, and J.M. Hill Nanotechnology 18 2007 275704
10. K. Yanagi, Y. Miyata, and H. Kataura Adv. Mater. 18 2006 437
11. Z.D. Su, S.H. Zhu, A.D. Donkor, C. Tzoganakis, and J.F. Honek J. Am. Chem. Soc. 133 2011 6874
12. U. Arsawang, O. Saengsawang, T. Rungrotmongkol, P. Sornmee, K. Wittayanarakul, T. Remsungnen, and S. Hannongbua J. Mol. Graph. Model. 29 2011 591
13. P. Sornmee, T. Rungrotmongkol, O. Saengsawang, U. Arsawang, T. Remsungnen, and S. Hannongbua J. Comput. Theor. Nanosci. 8 2011 1385
14. T.A. Hilder, and J.M. Hill Micro. Nano Lett. 3 2008 41
15. D. Vardanega, and F. Picaud J. Biotechnol. 144 2009 96
16. M.D. Ganji Fullerenes, Nanotubes, Carbon Nanostruct. 18 2010 24
17. Y. Kang, Y.-C. Liu, Q. Wang, J.-W. Shen, T. Wu, and W.-J. Guan Biomaterials 30 2009 2807
18. Q. Chen, Q. Wang, Y.-C. Liu, T. Wu, Y. Kang, J.D. Moore, and K.E. Gubbins J. Chem. Phys. 131 2009 015101
19. V.V. Chaban, T.I. Savchenko, S.M. Kovalenko, and O.V. Prezhdo J. Phys. Chem. B 114 2010 13481
20. E. Sabini, S. Hazra, M. Konrad, and A. Lavie J. Med. Chem. 50 2007 3004
21. Y. Duan J. Comput. Chem. 24 2003 1999
22. T. Rungrotmongkol Chem. Phys. Lett. 507 2011 134
23. A.M. Ferrari, G. Degliesposti, M. Sgobba, and G. Rastelli Bioorg. Med. Chem. 15 2007 7865
24. W.C. Still, A. Tempczyk, R.C. Hawley, and T. Hendrickson J. Am. Chem. Soc. 112 1990 6127
25. X. Lu, and Z. Chen Chem. Rev. 105 2005 3643
26. S. Miyamoto, and P. Kollman J. Comput. Chem. 13 1992 952
27. U. Essmann, L. Perera, M. Berkowitz, T. Darden, H. Lee, and L. Pedersen J. Chem. Phys. 103 1995 8577
28. P. Mignon, S. Loverix, J. Steyaert, and P. Geerlings Nucleic Acids Res. 33 2005 1779
29. C. Ban, B. Ramakrishnan, and M. Sundaralingam Nucleic Acids Res. 22 1994 5466
30. N. Nunthaboot J. Chem. Inf. Model. 50 2010 1410
31. C. Laohpongspaisan J. Chem. Inf. Model. 49 2009 847
32. T. Rungrotmongkol, T. Udommaneethanakit, M. Malaisree, N. Nunthaboot, P. Intharathep, P. Sompornpisut, and S. Hannongbua Biophys. Chem. 145 2009 29