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Exploring the Molecular Dynamics of a Lipid-A Vesicle at the Atom Level: Morphology and Permeation Mechanism

[Image: see text] Lipid-A was previously shown to spontaneously aggregate into a vesicle via the hybrid particle field approach. We assess the validity of the proposed vesiculation mechanism by simulating the resulting lipid-A vesicle at the atom level. The spatial confinement imposed by the vesicle...

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Detalles Bibliográficos
Autores principales: Santos, Denys E. S., De Nicola, Antonio, dos Santos, Vinicius F., Milano, Giuseppe, Soares, Thereza A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10405212/
https://www.ncbi.nlm.nih.gov/pubmed/37467380
http://dx.doi.org/10.1021/acs.jpcb.3c02848