Steered molecular dynamics simulations of ions traversing through carbon nanotubes

Acta Chimica Sinica

Volumn 69, Issue 24, 2011, Pages 2901-2907

  He, Zhongjin ^a   Zhou, Jian ^a  

^a SOUTH CHINA UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

Carbon nanotube; Ion hydration; Ion selectivity; Steered molecular dynamics; Umbrella sampling

Indexed keywords

EID: 84862600453     PISSN: 05677351     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (26)

1. Iijima S. Nature 1991 354 56.
2. Tasis D., Tagmatarchis N., Bianco A., Prato M. Chem. Rev. 2006 106 1105.
3. Sholl D. S., Johnson J. K. Science 2006 312 1003.
4. Wang J., Zhu Y., Zhou J., Lu X. H. Acta Chim. Sinica 2003 61 1891 (in Chinese).
5. Alexiadis A., Kassinos S. Chem. Rev. 2008 108 5014.
6. Shao Q., Huang L. L., Lu X. H., Lu L. H., Zhu Y. D., Shen W. F. Acta Chim. Sinica 2007 65 2217 (in Chinese).
7. Li C. X., Tian R., Lu G. W., Wang Z. H., Wang W. C. Acta Chim. Sinica 2003 61 175 (in Chinese).
8. Shi H. B., Yu Y. X., Gao G. H. Acta Chim. Sinica 2005 63 358 (in Chinese).
9. Feng H. J., Zhou J., Lu X. H. Acta Chim. Sinica 2009 67 2407 (in Chinese).
10. Feng H. J., Zhou J., Lu X. H., Fichthorn K. A. J. Chem. Phys. 2010 133.
11. Shao Q., Zhou J., Lu L. H., Lu X. H., Zhu Y. D., Jiang S. Y. Nano Lett. 2009 9 989.
12. Liu H. M., Murad S., Jameson C. J. J. Chem. Phys. 2006 125 084713.
13. Beu T. A. J. Chem. Phys. 2010 132 164513.
14. Isralewitz B., Gao M., Schulten K. Curr. Opin. Struct. Biol. 2001 11 224.
15. Torrie G. M., Valleau J. P. J. Comput. Phys. 1977 23 187.
16. Hess B., Kutzner C., van der Spoel D., Lindahl E. J. Chem. Theory Comput. 2008 4 435.
17. Hummer G., Rasaiah J. C., Noworyta J. P. Nature 2001 414 188.
18. Berendsen H. J. C., Grigera J. R., Straatsma T. P. J. Phys. Chem. 1987 91 6269.
19. Darden T., York D., Pedersen L. J. Chem. Phys. 1993 98 10089.
20. Hoover W. G. Phys. Rev. A 1985 31 1695.
21. Kumar S., Rosenberg J. M., Bouzida D., Swendsen R. H., Kollman P. A. J. Comput. Chem. 1992 13 1011.
22. Peter C., Hummer G. Biophys. J. 2005 89 2222.
23. Corry B. J. Phys. Chem. B 2008 112 1427.
24. Hille B. Ion Channels of Excitable Membranes, Sinauer, Associates, Sunderland, MA, 2001, p. 814.
25. Jiang Y., Lee A., Chen J., Cadene M., Chait B. T., MacKinnon R. Nature 2002 417 523.
26. Zhou J., Lu X. H., Wang Y. R., Shi J. Fluid Phase Equilib. 2002 194 257.