Lipid Composition Is Critical for Accurate Membrane Permeability Prediction of Cyclic Peptides by Molecular Dynamics Simulations

[Image: see text] Cyclic peptides have attracted attention as a promising pharmaceutical modality due to their potential to selectively inhibit previously undruggable targets, such as intracellular protein–protein interactions. Poor membrane permeability is the biggest bottleneck hindering successfu...

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Detalles Bibliográficos
Autores principales: Sugita, Masatake, Fujie, Takuya, Yanagisawa, Keisuke, Ohue, Masahito, Akiyama, Yutaka
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9516681/
https://www.ncbi.nlm.nih.gov/pubmed/36053061
http://dx.doi.org/10.1021/acs.jcim.2c00931

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9516681/
https://www.ncbi.nlm.nih.gov/pubmed/36053061
http://dx.doi.org/10.1021/acs.jcim.2c00931

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