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Molecular Simulation Volume 43, 2017 - Issue 13-16: Proceedings of the 4th International Conference on Molecular Simulation
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Articles

Carbon nanotube prevents the secondary structure formation of amyloid-β trimers: an all-atom molecular dynamics study

Menghua SongCollege of Mathematics and Physics, Shanghai University of Electric Power, Shanghai, P.R. China;College of Energy and Mechanical Engineering, Shanghai University of Electric Power, Shanghai, P.R. China
,
Yanyan ZhuCollege of Mathematics and Physics, Shanghai University of Electric Power, Shanghai, P.R. China
,
Guanghong WeiState Key Laboratory of Surface Physics, Key Laboratory of Computational Physical Sciences(Ministry of Education), and Department of Physics, Fudan University, Shanghai, P.R. China
&
Huiyu LiCollege of Mathematics and Physics, Shanghai University of Electric Power, Shanghai, P.R. China;State Key Laboratory of Surface Physics, Key Laboratory of Computational Physical Sciences(Ministry of Education), and Department of Physics, Fudan University, Shanghai, P.R. ChinaCorrespondence[email protected]
Pages 1189-1195 | Received 31 Jan 2017, Accepted 14 Apr 2017, Published online: 23 May 2017

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Xiaoyu Wang, Menghua Song, Shuang Zhao, Huiyu Li, Qingjie Zhao & Jingshan Shen. (2020) Molecular dynamics simulations reveal the mechanism of the interactions between the inhibitors and SIRT2 at atom level. Molecular Simulation 46:8, pages 638-649.
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Articles from other publishers (8)

Stefano A. Mezzasalma, Lucia Grassi & Mario Grassi. (2021) Physical and chemical properties of carbon nanotubes in view of mechanistic neuroscience investigations. Some outlook from condensed matter, materials science and physical chemistry. Materials Science and Engineering: C 131, pages 112480.
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Li Chen, Shuang Zhao, Yanyan Zhu, Yongsheng Liu, Huiyu Li & Qingjie Zhao. (2021) Molecular Dynamics Simulations Reveal the Modulated Mechanism of STING Conformation. Interdisciplinary Sciences: Computational Life Sciences 13:4, pages 751-765.
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Nidhi Sorout & Amalendu Chandra. (2021) Interactions of the Aβ(1–42) Peptide with Boron Nitride Nanoparticles of Varying Curvature in an Aqueous Medium: Different Pathways to Inhibit β-Sheet Formation. The Journal of Physical Chemistry B 125:40, pages 11159-11178.
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Yuqi Zhang, Li Chen, Xiaoyu Wang, Yanyan Zhu, Yongsheng Liu, Huiyu Li & Qingjie Zhao. (2021) Interactive Mechanism of Potential Inhibitors with Glycosyl for SARS-CoV-2 by Molecular Dynamics Simulation. Processes 9:10, pages 1749.
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Ning Kang, Jin Hua, Lizhen Gao, Bin Zhang & Jiewen Pang. (2021) The Interplay between Whey Protein Fibrils with Carbon Nanotubes or Carbon Nano-Onions. Materials 14:3, pages 608.
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Shuang Zhao, Yan-Yan Zhu, Xiao-Yu Wang, Yong-Sheng Liu, Yun-Xiang Sun, Qing-Jie Zhao & Hui-Yu Li. (2020) Structural Insight into the Interactions between Structurally Similar Inhibitors and SIRT6. International Journal of Molecular Sciences 21:7, pages 2601.
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Nidhi Sorout & Amalendu Chandra. (2020) Effects of Boron Nitride Nanotube on the Secondary Structure of Aβ(1–42) Trimer: Possible Inhibitory Effect on Amyloid Formation. The Journal of Physical Chemistry B 124:10, pages 1928-1940.
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Menghua Song, Yunxiang Sun, Yin Luo, Yanyan Zhu, Yongsheng Liu & Huiyu Li. (2018) Exploring the Mechanism of Inhibition of Au Nanoparticles on the Aggregation of Amyloid-β(16-22) Peptides at the Atom Level by All-Atom Molecular Dynamics. International Journal of Molecular Sciences 19:6, pages 1815.
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