Content area

Abstract

The structural change of a phospholipid bilayer in water under the action of a shock wave is numerically studied with unsteady nonequilibrium molecular dynamics simulations. The action of shock waves is modeled by the momentum change of water molecules, and thereby we demonstrate that the resulting collapse and rebound of the bilayer are followed by the penetration of water molecules into the hydrophobic region of the bilayer. The high-speed phenomenon that occurs during the collapse and rebound of the bilayer is analyzed in detail, particularly focusing on the change of bilayer thickness, the acyl chain bend angles, the lateral fluidity of lipid molecules, and the penetration rate of water molecules. The result shows that the high-speed phenomenon can be divided into two stages: in the first stage the thickness of bilayer and the order parameter are rapidly reduced, and then in the second stage they are recovered relatively slowly. It is in the second stage that water molecules are steadily introduced into the hydrophobic region. The penetration of water molecules is enhanced by the shock wave impulse and this qualitatively agrees with a recent experimental result. [PUBLICATION ABSTRACT]

Details

Title
Structural Change in Lipid Bilayers and Water Penetration Induced by Shock Waves: Molecular Dynamics Simulations
Publication title
Volume
91
Issue
6
Pages
2198-205
Number of pages
8
Publication year
2006
Publication date
Sep 15, 2006
Publisher
Biophysical Society
Place of publication
New York
Country of publication
United States
Publication subject
ISSN
00063495
e-ISSN
15420086
Source type
Scholarly Journal
Language of publication
English
Document type
Journal Article
Document feature
Diagrams; Equations; Photographs; Graphs; References
Accession number
16798798
ProQuest document ID
215714024
Document URL
https://www.proquest.com/scholarly-journals/structural-change-lipid-bilayers-water/docview/215714024/se-2?accountid=208611
Copyright
Copyright Biophysical Society Sep 15, 2006
Last updated
2024-10-05
Database
ProQuest One Academic