Protein-Water and Water-Water Long-Time Relaxations in Protein Hydration Water upon Cooling—A Close Look through Density Correlation Functions

Protein-Water and Water-Water Long-Time Relaxations in Protein Hydration Water upon Cooling—A Close Look through Density Correlation Functions

We report results on the translational dynamics of the hydration water of the lysozyme protein upon cooling obtained by means of molecular dynamics simulations. The self van Hove functions and the mean square displacements of hydration water show two different temperature activated relaxation mechan...

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Bibliographic Details
Main Authors: Lorenzo Tenuzzo, Gaia Camisasca, Paola Gallo
Format: Article
Language:English
Published: MDPI AG 2020-10-01
Series:Molecules
Subjects:
hydration water
supercooled water
slow dynamics
molecular dynamics simulations
structural relaxations
hopping
Online Access:https://www.mdpi.com/1420-3049/25/19/4570

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