抗体设计的分子动力学方法。
Molecular Dynamics Methods for Antibody Design.
机构信息
Department of Bioengineering, University of Washington, Seattle, WA, USA.
出版信息
Methods Mol Biol. 2023;2552:109-124. doi: 10.1007/978-1-0716-2609-2_5.
PMID:36346588
Abstract
Complex and coordinated dynamics are closely connected with protein functions, including the binding of antibodies to antigens. Knowledge of such dynamics could improve the design of antibodies. Molecular dynamics (MD) simulations provide a "computational microscope" that can resolve atomic motions and inform antibody design efforts.
摘要
复杂协调的动力学与蛋白质功能密切相关，包括抗体与抗原的结合。了解这种动力学可以改进抗体的设计。分子动力学（MD）模拟提供了一个“计算显微镜”，可以解析原子运动，并为抗体设计工作提供信息。
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