Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study

NWIPB OpenIR

	Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study
	Ma, Ke-Sheng ; You, Jin-Mao ; Zhou, Zheng-Yu ; Su, Chun-Fang ; Wang, Xiang-Xiang
	2010-06-01
发表期刊	INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY ; Ma, KS; You, JM; Zhou, ZY; Su, CF; Wang, XX.Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study,INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,2010,110(7):1425-1431
摘要	Various possible structures of adenine-uracil-formamide hydrogenbond complexes were optimized at 6-311+ +G(d,p) level, and the binding energies of these complexes were also calculated at DFT B3LYP/6-311++G(d,p) level. Eight stable cyclic structures being involved in the interaction are found on the potential energy surface. By analyzing the structure, NPA charge and interaction energy of complexes, we obtain the most stable geometry structure. The results show that the interactions between formamide and adenine-uracil (A-U) base pair affect the stabilities of the base pairs. (C) 2009 Wiley Periodicals, Inc. Int I Quantum Chem 110: 1425-1431, 2010; Various possible structures of adenine-uracil-formamide hydrogenbond complexes were optimized at 6-311+ +G(d,p) level, and the binding energies of these complexes were also calculated at DFT B3LYP/6-311++G(d,p) level. Eight stable cyclic structures being involved in the interaction are found on the potential energy surface. By analyzing the structure, NPA charge and interaction energy of complexes, we obtain the most stable geometry structure. The results show that the interactions between formamide and adenine-uracil (A-U) base pair affect the stabilities of the base pairs. (C) 2009 Wiley Periodicals, Inc. Int I Quantum Chem 110: 1425-1431, 2010
文献类型	期刊论文
条目标识符	http://210.75.249.4/handle/363003/30719
专题	中国科学院西北高原生物研究所
推荐引用方式 GB/T 7714	Ma, Ke-Sheng,You, Jin-Mao,Zhou, Zheng-Yu,et al. Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study[J]. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, Ma, KS; You, JM; Zhou, ZY; Su, CF; Wang, XX.Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study,INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,2010,110(7):1425-1431,2010.
APA	Ma, Ke-Sheng,You, Jin-Mao,Zhou, Zheng-Yu,Su, Chun-Fang,&Wang, Xiang-Xiang.(2010).Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study.INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY.
MLA	Ma, Ke-Sheng,et al."Interaction Between RNA Segment (Adenine-Uracil) and Model of Protein Unit (Formamide): A Density-Functional Theory Study".INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2010).