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Physics-Based Method for Modeling Passive Membrane Permeability and Translocation Pathways of Bioactive Molecules

Assessment of permeability is a critical step in the drug development process for selection of drug candidates with favorable ADME properties. We have developed a novel physics-based method for fast computational modeling of passive permeation of diverse classes of molecules across lipid membranes....

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Detalhes bibliográficos
Publicado no:J Chem Inf Model
Main Authors: Lomize, Andrei L., Pogozheva, Irina D.
Formato: Artigo
Idioma:Inglês
Publicado em: 2019
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC6756154/
https://ncbi.nlm.nih.gov/pubmed/31259555
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jcim.9b00224
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