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Pressure effects on collective density fluctuations in water and protein solutions

Articolo
Data di Pubblicazione:
2017
Abstract:
Neutron Brillouin scattering and molecular dynamics simulations have been used to investigate protein hydration water density fluctuations as a function of pressure. Our results show significant differences between the pressure and density dependence of collective dynamics in bulk water and in concentrated protein solutions. Pressure-induced changes in the tetrahedral order of the water HB network have direct consequences for the high-frequency sound velocity and damping coefficients, which we find to be a sensitive probe for changes in the HB network structure as well as the wetting of biomolecular surfaces.
Tipologia CRIS:
01.01 Articolo in rivista
Keywords:
Collective THz modes; High pressure; Hydration water; Molecular dynamics; Neutron scattering
Elenco autori:
Laloni, Alessio; Russo, Daniela
Autori di Ateneo:
LALONI ALESSIO
RUSSO DANIELA
Link alla scheda completa:
https://iris.cnr.it/handle/20.500.14243/346210
Pubblicato in:
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (ONLINE)
Journal
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URL

https://www.pnas.org/doi/10.1073/pnas.1705279114
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