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Updated: Jul 27, 2025

Author Spotlight: Exploring Intrinsically Disordered Protein Dynamics Through NMR Relaxation Experiments
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Author Spotlight: Exploring Intrinsically Disordered Protein Dynamics Through NMR Relaxation Experiments

Published on: November 1, 2024

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将力场参数与NMR放松数据相匹配

Felix Kümmerer1, Simone Orioli1,2, Kresten Lindorff-Larsen1

  • 1Structural Biology and NMR Laboratory, Linderstrøm-Lang Centre for Protein Science, Department of Biology, University of Copenhagen, Ole Maaløes Vej 5, DK-2200 Copenhagen N, Denmark.

Journal of chemical theory and computation
|June 5, 2023
PubMed
概括

用NMR放松数据优化蛋白质力场可以改善模拟. 修改的参数增强了与实验数据的一致性,并更好地代表了溶液中的蛋白质动态.

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