鉴定多肽动力学中的亚稳态。
Identification of metastable states in peptide's dynamics.
机构信息
Department of Energy and Environment, Chalmers University of Technology, Gothenburg 412 96, Sweden.
出版信息
J Chem Phys. 2010 Oct 28;133(16):164102. doi: 10.1063/1.3493333.
PMID:21033770
Abstract
A recently developed spectral method for identifying metastable states in Markov chains is used to analyze the conformational dynamics of a four-residue peptide valine-proline-alanine-leucine. We compare our results to empirically defined conformational states and show that the found metastable states correctly reproduce the conformational dynamics of the system.
摘要
最近开发的一种用于识别马尔可夫链中亚稳态的谱方法被用于分析四残基肽缬氨酸-脯氨酸-丙氨酸-亮氨酸的构象动力学。我们将我们的结果与经验定义的构象状态进行比较，并表明发现的亚稳态正确地再现了系统的构象动力学。
Zotero 插件