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首页> 外文期刊>Journal of Computational Chemistry: Organic, Inorganic, Physical, Biological >Software News and Update Diffusion-Collision Model Algorithms for Protein Folding Kinetics
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Software News and Update Diffusion-Collision Model Algorithms for Protein Folding Kinetics

机译:蛋白质折叠动力学的软件新闻和更新扩散碰撞模型算法

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摘要

The diffusion-collision model (DCM) of protein folding is described qualitatively and quantitatively.The input parameters required to perform a calculation are explained,and the output data are outlined.Three examples are given of calculating DCM folding kinetics: the Engrailed Homeodomain (a three-helix bundle with three helical microdomains,pdb code 1ENH),protein G (with three microdomains having a beta-hairpin-o;-helix-beta-hairpin motif,pdb code 1PGA),and apomyoglobin (with eight helices and seven strong microdomain-microdomain pairings).
机译:定性和定量地描述了蛋白质折叠的扩散碰撞模型(DCM)。解释了进行计算所需的输入参数,并概述了输出数据。给出了计算DCM折叠动力学的三个示例:Engrailed Homeodomain(a具有三个螺旋微域的三螺旋束,pdb代码为1ENH),蛋白G(具有三个微域的β-hairpin-o;-螺旋-β-hairpin基序,pdb代码为1PGA)和磷肌红蛋白(具有八个螺旋和七个微域-微域配对)。

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