Multi-scale molecular dynamics simulations and applications on mechanosensitive proteins of integrins*

doi:10.1088/1674-1056/abc540

	Multi-scale molecular dynamics simulations and applications on mechanosensitive proteins of integrins*
	Lu, Shouqin 1,3,4; Ding, Qihan 1,3,4; Zhang, Mingkun 1,2,3,4; Long, Mian 1,3,4
刊名	CHINESE PHYSICS B
	2021-03-01
卷号	30 期号:3 页码:8
关键词	molecular dynamics simulations mechanosensitive protein allosteric dynamics integrin
ISSN号	1674-1056
DOI	10.1088/1674-1056/abc540
通讯作者	Long, Mian(mlong@imech.ac.cn)
英文摘要	Molecular dynamics simulation (MDS) is a powerful technology for investigating evolution dynamics of target proteins, and it is used widely in various fields from materials to biology. This mini-review introduced the principles, main preforming procedures, and advances of MDS, as well as its applications on the studies of conformational and allosteric dynamics of proteins especially on that of the mechanosensitive integrins. Future perspectives were also proposed. This review could provide clues in understanding the potentiality of MD simulations in structure-function relationship investigation of biological proteins.
资助项目	National Key Research and Development Program of China[2016YFA0501601] ; National Natural Science Foundation of China[91642203] ; National Natural Science Foundation of China[31627804] ; National Natural Science Foundation of China[11972042] ; Frontier Science Key Project of the Chinese Academy of Sciences[QYZDJ-SSWJSC018] ; Scientific Instrument Developing Project of the Chinese Academy of Sciences[GJJSTU20190005] ; Strategic Priority Research Program of the Chinese Academy of Sciences[XDB22040101]
WOS研究方向	Physics
语种	英语
出版者	IOP PUBLISHING LTD
WOS记录号	WOS:000630459500001
内容类型	期刊论文
源URL	[http://119.78.100.138/handle/2HOD01W0/13158]
专题	中国科学院重庆绿色智能技术研究院
通讯作者	Long, Mian
作者单位	1.Chinese Acad Sci, Inst Mech, CAS Ctr Excellence Complex Syst Mech, Beijing 100190, Peoples R China 2.Chinese Acad Sci, Chongqing Inst Green & Intelligent Technol, Chongqing Engn Res Ctr High Resolut & Dynam Imagi, Chongqing 400714, Peoples R China 3.Univ Chinese Acad Sci, Sch Engn Sci, Beijing 101408, Peoples R China 4.Chinese Acad Sci, Ctr Biomech & Bioengn, Beijing Key Lab Engn Construct & Mechanobiol, Key Lab Micrograv,Natl Micrograv Lab, Beijing 100190, Peoples R China
推荐引用方式 GB/T 7714	Lu, Shouqin,Ding, Qihan,Zhang, Mingkun,et al. Multi-scale molecular dynamics simulations and applications on mechanosensitive proteins of integrins*[J]. CHINESE PHYSICS B,2021,30(3):8.
APA	Lu, Shouqin,Ding, Qihan,Zhang, Mingkun,&Long, Mian.(2021).Multi-scale molecular dynamics simulations and applications on mechanosensitive proteins of integrins*.CHINESE PHYSICS B,30(3),8.
MLA	Lu, Shouqin,et al."Multi-scale molecular dynamics simulations and applications on mechanosensitive proteins of integrins*".CHINESE PHYSICS B 30.3(2021):8.