中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
Two-Dimensional Infrared (2DIR) Spectroscopy of the Peptide Beta3s Folding

文献类型:期刊论文

作者Lai ZZ ; Preketes NK ; Jiang J ; Mukamel S ; Wang J
刊名journal of physical chemistry letters
出版日期2013
卷号4期号:11页码:1913-1917
关键词DYNAMICS FORCE-FIELDS SECONDARY STRUCTURE MOLECULAR-DYNAMICS AMIDE-I PROTEIN SHEET HAIRPIN ENERGY SIMULATIONS CHARMM
ISSN号1948-7185
通讯作者wang j
中文摘要probing the underlying free-energy landscape, pathway, and mechanism is the key to understanding protein folding in theory and experiment. time-resolved two-dimensional infrared (2dir) with femtosecond laser pulses has emerged as a powerful tool for investigating the protein folding dynamics on much faster time scales than possible by nmr we have employed molecular dynamics simulations to compute 2dir spectra of the folding process of a peptide, beta3s. simulated nonchiral and chiral 2dir signals illustrate the variation of the spectra as the peptide conformation evolves along the free-energy landscape. chiral spectra show stronger changes than the nonchiral signals because cross peaks caused by the formation of the beta-sheet are clearly resolved. chirality-induced 2dir may be used to detect the folding of beta-sheet proteins with high spectral and temporal resolution.
收录类别SCI收录期刊论文
语种英语
WOS记录号WOS:000320214600026
公开日期2014-04-15
源URL[http://ir.ciac.jl.cn/handle/322003/49803]  
专题长春应用化学研究所_长春应用化学研究所知识产出_期刊论文
推荐引用方式
GB/T 7714
Lai ZZ,Preketes NK,Jiang J,et al. Two-Dimensional Infrared (2DIR) Spectroscopy of the Peptide Beta3s Folding[J]. journal of physical chemistry letters,2013,4(11):1913-1917.
APA Lai ZZ,Preketes NK,Jiang J,Mukamel S,&Wang J.(2013).Two-Dimensional Infrared (2DIR) Spectroscopy of the Peptide Beta3s Folding.journal of physical chemistry letters,4(11),1913-1917.
MLA Lai ZZ,et al."Two-Dimensional Infrared (2DIR) Spectroscopy of the Peptide Beta3s Folding".journal of physical chemistry letters 4.11(2013):1913-1917.

入库方式: OAI收割

来源:长春应用化学研究所

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