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Predicting asymmetric phospholipid microstructures in solutions

Asymmetric phospholipid microstructures, such as asymmetric phospholipid membranes, have potential applications in biological and medicinal processes. Here, we used the dissipative particle dynamics simulation method to predict the asymmetric phospholipid microstructures in aqueous solutions. The as...

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Detalles Bibliográficos
Autores principales: Shan, Yue, Ji, Yongyun, Wang, Xianghong, He, Linli, Li, Shiben
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9055179/
https://www.ncbi.nlm.nih.gov/pubmed/35516199
http://dx.doi.org/10.1039/d0ra03732j
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author Shan, Yue
Ji, Yongyun
Wang, Xianghong
He, Linli
Li, Shiben
author_facet Shan, Yue
Ji, Yongyun
Wang, Xianghong
He, Linli
Li, Shiben
author_sort Shan, Yue
collection PubMed
description Asymmetric phospholipid microstructures, such as asymmetric phospholipid membranes, have potential applications in biological and medicinal processes. Here, we used the dissipative particle dynamics simulation method to predict the asymmetric phospholipid microstructures in aqueous solutions. The asymmetric phospholipid membranes, tubes and vesicles are determined and characterized by the chain density distributions and order parameters. The phase diagrams are constructed to evaluate the effects of the chain length on the asymmetric structure formations at equilibrium states, while the average radius of gyration and shape factors are calculated to analyze the asymmetric structure formations in the non-equilibrium processes. Meanwhile, we predicted the mechanical properties of the asymmetric membranes by analyzing the spatial distributions of the interface tensions and osmotic pressures in solutions.
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spelling pubmed-90551792022-05-04 Predicting asymmetric phospholipid microstructures in solutions Shan, Yue Ji, Yongyun Wang, Xianghong He, Linli Li, Shiben RSC Adv Chemistry Asymmetric phospholipid microstructures, such as asymmetric phospholipid membranes, have potential applications in biological and medicinal processes. Here, we used the dissipative particle dynamics simulation method to predict the asymmetric phospholipid microstructures in aqueous solutions. The asymmetric phospholipid membranes, tubes and vesicles are determined and characterized by the chain density distributions and order parameters. The phase diagrams are constructed to evaluate the effects of the chain length on the asymmetric structure formations at equilibrium states, while the average radius of gyration and shape factors are calculated to analyze the asymmetric structure formations in the non-equilibrium processes. Meanwhile, we predicted the mechanical properties of the asymmetric membranes by analyzing the spatial distributions of the interface tensions and osmotic pressures in solutions. The Royal Society of Chemistry 2020-06-26 /pmc/articles/PMC9055179/ /pubmed/35516199 http://dx.doi.org/10.1039/d0ra03732j Text en This journal is © The Royal Society of Chemistry https://creativecommons.org/licenses/by/3.0/
spellingShingle Chemistry
Shan, Yue
Ji, Yongyun
Wang, Xianghong
He, Linli
Li, Shiben
Predicting asymmetric phospholipid microstructures in solutions
title Predicting asymmetric phospholipid microstructures in solutions
title_full Predicting asymmetric phospholipid microstructures in solutions
title_fullStr Predicting asymmetric phospholipid microstructures in solutions
title_full_unstemmed Predicting asymmetric phospholipid microstructures in solutions
title_short Predicting asymmetric phospholipid microstructures in solutions
title_sort predicting asymmetric phospholipid microstructures in solutions
topic Chemistry
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9055179/
https://www.ncbi.nlm.nih.gov/pubmed/35516199
http://dx.doi.org/10.1039/d0ra03732j
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