Docking of HIV protease to silver nanoparticles
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- 作者：C.G. Whiteleya ; c.whiteley@mail.ntust.edu.tw" class="auth_mail" title="E-mail the corresponding author ; c.whiteley@ru.ac.za" class="auth_mail" title="E-mail the corresponding author ; C-Y Shingc ; C-C Kuoc ; Duu-Jong Leeb ; c
- 关键词：HIV protease ; Silver nanoparticles ; Docking ; Molecular dynamics simulation
- 刊名：Journal of the Taiwan Institute of Chemical Engineers
- 出版年：2016
- 出版时间：March 2016
- 年：2016
- 卷：60
- 期：Complete
- 页码：83-91
- 全文大小：2305 K
文摘
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Molecular dynamic simulation of docking HIVPR with silver nanoparticles.
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Analysis by RMSD, CD, Rg, electrostatic potentials, dihedral angle changes.
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Decrease in α-helix and β-sheets; concomitant increase in random coil.
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Gyration radius identifies docking site initially flexible then becomes stable.