The Electron Transfer Path Between Cytochrome C and Single-walled Carbon Manotubes Based on Quantum Mechanics

摘要：

　　By analyzing the shortest path between cytochrome c(Cytc)and single-walled carbon nanotubes(SWNTs),the study investigated electron transfer mechanism.By simplifying the snapshots model of SWNT(10,10)-(Cytc)at 10 ns,the charge density of the simplified model was calculated by using quantum mechanics simulation and the charge density image was drawn.On the basis,the study discussed and verified the electron transfer mechanism and paths between Cytc and SWNTs at the optimal localization.The result revealed that the electrons were transferred to Cytc protein from the surfaces of SWNTs through Cys18.

作者: Xin-xin WANG Ying-xue XU Yin-jie LIAO Shi-jie ZHOU Bing ZHANG

作者单位: College of Renewable Energy,North China Electric Power University,Beijing,China College of Renewable Energy, North China Electric Power University, Beijing Key Laboratory of Energy

会议类型: 国际会议

会议名称: The 2017 2nd International Seminar on Applied Physics, Optoelectronics and Photonics (APOP 2017) (2017年第二届应用物理、光电子学和光子学国际研讨会)

会议地点: 上海

会议语种:英文

页码: 468-473

在线出版日期: 2017-12-30（万方平台首次上网日期，不代表论文的发表时间）