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pH-Dependent Conformations of an Antimicrobial Spider Venom Peptide, Cupiennin 1a, from Unbiased HREMD Simulations

[Image: see text] Cupiennin 1a is an antimicrobial peptide found in the venom of the spider Cupiennius salei. A highly cationic peptide, its cell lysis activity has been found to vary between neutral and charged membranes. In this study, Hamiltonian replica-exchange molecular dynamics (HREMD) was us...

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Detalles Bibliográficos
Autores principales:	Gaza, Jokent T., Leyson, Jarold John C., Peña, Gardee T., Nellas, Ricky B.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	American Chemical Society 2021
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8459419/ https://www.ncbi.nlm.nih.gov/pubmed/34568695 http://dx.doi.org/10.1021/acsomega.1c03729

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