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Analytical Approaches for Deriving Friction Coefficients for Selected α-Helical Peptides Based Entirely on Molecular Dynamics Simulations

[Image: see text] In this paper we derive analytically from molecular dynamics (MD) simulations the friction coefficients related to conformational transitions within several model peptides with α-helical structures. We study a series of alanine peptides with various length from ALA(5) to ALA(21) as...

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Detalles Bibliográficos
Autores principales: Wosztyl, Aleksandra, Kuczera, Krzysztof, Szoszkiewicz, Robert
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9661531/
https://www.ncbi.nlm.nih.gov/pubmed/36300354
http://dx.doi.org/10.1021/acs.jpcb.2c03076