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Dynamics of Hydration Water Plays a Key Role in Determining the Binding Thermodynamics of Protein Complexes

Interfacial waters are considered to play a crucial role in protein–protein interactions, but in what sense and why are they important? Here, using molecular dynamics simulations and statistical thermodynamic analyses, we demonstrate distinctive dynamic characteristics of the interfacial water and i...

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Detalhes bibliográficos
Publicado no:Sci Rep
Main Authors: Chong, Song-Ho, Ham, Sihyun
Formato: Artigo
Idioma:Inglês
Publicado em: Nature Publishing Group UK 2017
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC5562873/
https://ncbi.nlm.nih.gov/pubmed/28821854
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1038/s41598-017-09466-w
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