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In Silico Prediction of Stratum Corneum Partition Coefficients via COSMOmic and Molecular Dynamics Simulations

[Image: see text] Stratum corneum (SC) is the main barrier of human skin where the inter-corneocytes lipids provide the main pathway for transdermal permeation of functional actives of skin care and health. Molecular dynamics (MD) has been increasingly used to simulate the SC lipid bilayer structure...

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Detalles Bibliográficos
Autores principales: Piasentin, Nicola, Lian, Guoping, Cai, Qiong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10068742/
https://www.ncbi.nlm.nih.gov/pubmed/36930176
http://dx.doi.org/10.1021/acs.jpcb.2c08566