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Finite-Size Effects in Simulations of Peptide/Lipid Assembly

ABSTRACT: Molecular dynamics simulations are an attractive tool for understanding lipid/peptide self-assembly but can be plagued by inaccuracies when the system sizes are too small. The general guidance from self-assembly simulations of homogeneous micelles is that the total number of surfactants sh...

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Detalles Bibliográficos
Autores principales: Jarin, Zack, Agolini, Olivia, Pastor, Richard W.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9581812/
https://www.ncbi.nlm.nih.gov/pubmed/35854128
http://dx.doi.org/10.1007/s00232-022-00255-9