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	Combined QM(DFT)/MM Molecular Dynamics Simulations of the Deamination of Cytosine by Yeast Cytosine Deaminase (yCD)
	Zhang, Xin[1]; Zhao, Yuan[2]; Yan, Honggao[3]; Cao, Zexing[4]; Mo, Yirong[5]
刊名	JOURNAL OF COMPUTATIONAL CHEMISTRY
	2016
卷号	37期号:13页码:1163-1174
关键词	molecular dynamics combined QM/MM DFT cytosine enzymatic catalysis
ISSN号	0192-8651
DOI	http://dx.doi.org/10.1002/jcc.24306
URL标识	查看原文
收录类别	SCI(E) ; EI
WOS记录号	WOS:000374707000003
内容类型	期刊论文
URI标识	http://www.corc.org.cn/handle/1471x/5203894
专题	河南大学
作者单位	[1]State Key Laboratory of Chemical Resource Engineering, Institute of Materia Medica, College of Science, Beijing University of Chemical Technology, Beijing, 100029, China |Department of Chemistry, Western Michigan University, Kalamazoo, MI, 49008, United States [2]State Key Laboratory of Physical Chemistry of Solid Surfaces, Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen, 360015, China |Key Laboratory of Natural Medicine and Immuno-Engineering, Henan University, Kaifeng, 475004, China [3]Department of Biochemistry, Center for Biological Modeling, Michigan State University, East Lansing, MI, 48824, United States |Department of Chemistry, Center for Biological Modeling, Michigan State University, East Lansing, MI, 48824, United States[4]State Key Laboratory of Physical Chemistry of Solid Surfaces, Fujian Provincial Key Laboratory of Theoretical and Computational Chemistry, College of Chemistry and Chemical Engineering, Xiamen University, Xiamen, 360015, China [5]Department of Chemistry, Western Michigan University, Kalamazoo, MI, 49008, United States
推荐引用方式 GB/T 7714	Zhang, Xin[1],Zhao, Yuan[2],Yan, Honggao[3],et al. Combined QM(DFT)/MM Molecular Dynamics Simulations of the Deamination of Cytosine by Yeast Cytosine Deaminase (yCD)[J]. JOURNAL OF COMPUTATIONAL CHEMISTRY,2016,37(13):1163-1174.
APA	Zhang, Xin[1],Zhao, Yuan[2],Yan, Honggao[3],Cao, Zexing[4],&Mo, Yirong[5].(2016).Combined QM(DFT)/MM Molecular Dynamics Simulations of the Deamination of Cytosine by Yeast Cytosine Deaminase (yCD).JOURNAL OF COMPUTATIONAL CHEMISTRY,37(13),1163-1174.
MLA	Zhang, Xin[1],et al."Combined QM(DFT)/MM Molecular Dynamics Simulations of the Deamination of Cytosine by Yeast Cytosine Deaminase (yCD)".JOURNAL OF COMPUTATIONAL CHEMISTRY 37.13(2016):1163-1174.

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