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Vibrational Analysis of Hydration-Layer Water around Ubiquitin, Unpeeled Layer by Layer: Molecular-Dynamics Perceptions

Classical molecular-dynamics simulations have been performed to examine the interplay between ubiquitin and its hydration-water sub-layers, chiefly from a vibrational-mode and IR viewpoint—where we analyse individual sub-layers characteristics. The vibrational Density of States (VDOS) revealed that...

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Detalles Bibliográficos
Autores principales:	Martinez-Gonzalez, José Angel, Nandi, Prithwish K., English, Niall J., Gowen, Aoife
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	MDPI 2022
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9785973/ https://www.ncbi.nlm.nih.gov/pubmed/36555590 http://dx.doi.org/10.3390/ijms232415949

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