Self-Assembly of Lecithin and Bile Salt in the Presence of Inorganic Salt in Water: Mesoscale Computer Simulation
Тип публикации: Journal Article
Дата публикации: 2017-08-11
scimago Q1
wos Q3
БС2
SJR: 0.742
CiteScore: 5.3
Impact factor: 2.9
ISSN: 15206106, 15205207, 10895647
PubMed ID:
28737387
Materials Chemistry
Surfaces, Coatings and Films
Physical and Theoretical Chemistry
Краткое описание
The influence of inorganic salt on the structure of lecithin/bile salt mixtures in aqueous solution is studied by means of dissipative particle dynamics simulations. We propose a coarse-grained model of phosphatidylcholine and two types of bile salts (sodium cholate and sodium deoxycholate) and also take into account the presence of low molecular weight salt. This model allows us to study the system on rather large time and length scales (up to about ∼20 μs and 50 nm) and to reveal mechanisms of experimentally observed increasing viscosity upon increasing the low molecular weight salt concentration in this system. We show that increasing the low molecular weight salt concentration induces the growth of cylinder-like micelles formed in lecithin/bile salt mixtures in water. These wormlike micelles can entangle into transient networks displaying perceptible viscoelastic properties. Computer simulation results are in good qualitative agreement with experimental observations.
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Markina A. A. et al. Self-Assembly of Lecithin and Bile Salt in the Presence of Inorganic Salt in Water: Mesoscale Computer Simulation // Journal of Physical Chemistry B. 2017. Vol. 121. No. 33. pp. 7878-7888.
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Markina A. A., Ivanov V. A., Komarov P. V., Khokhlov A. R., Tung S. P. Self-Assembly of Lecithin and Bile Salt in the Presence of Inorganic Salt in Water: Mesoscale Computer Simulation // Journal of Physical Chemistry B. 2017. Vol. 121. No. 33. pp. 7878-7888.
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TY - JOUR
DO - 10.1021/acs.jpcb.7b04566
UR - https://doi.org/10.1021/acs.jpcb.7b04566
TI - Self-Assembly of Lecithin and Bile Salt in the Presence of Inorganic Salt in Water: Mesoscale Computer Simulation
T2 - Journal of Physical Chemistry B
AU - Markina, Anastasia A
AU - Ivanov, Viktor A.
AU - Komarov, Pavel V.
AU - Khokhlov, Alexei R.
AU - Tung, Shih Ping
PY - 2017
DA - 2017/08/11
PB - American Chemical Society (ACS)
SP - 7878-7888
IS - 33
VL - 121
PMID - 28737387
SN - 1520-6106
SN - 1520-5207
SN - 1089-5647
ER -
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@article{2017_Markina,
author = {Anastasia A Markina and Viktor A. Ivanov and Pavel V. Komarov and Alexei R. Khokhlov and Shih Ping Tung},
title = {Self-Assembly of Lecithin and Bile Salt in the Presence of Inorganic Salt in Water: Mesoscale Computer Simulation},
journal = {Journal of Physical Chemistry B},
year = {2017},
volume = {121},
publisher = {American Chemical Society (ACS)},
month = {aug},
url = {https://doi.org/10.1021/acs.jpcb.7b04566},
number = {33},
pages = {7878--7888},
doi = {10.1021/acs.jpcb.7b04566}
}
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MLA
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Markina, Anastasia A., et al. “Self-Assembly of Lecithin and Bile Salt in the Presence of Inorganic Salt in Water: Mesoscale Computer Simulation.” Journal of Physical Chemistry B, vol. 121, no. 33, Aug. 2017, pp. 7878-7888. https://doi.org/10.1021/acs.jpcb.7b04566.