Shock wave interaction with a phospholipid membrane: Coarse-grained computer simulations

被引:48
作者
Santo, Kolattukudy P. [1 ]
Berkowitz, Max L. [1 ]
机构
[1] Univ N Carolina, Dept Chem, Chapel Hill, NC 27599 USA
关键词
MOLECULAR-DYNAMICS SIMULATIONS; TRAUMATIC BRAIN-INJURY; CAVITATION BUBBLES; MODEL; ULTRASOUND; MIXTURES; WATER;
D O I
10.1063/1.4862987
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We used MARTINI coarse-grained force field to study poration of a lipid bilayer by a shock wave induced nanobubble collapse. Different systems containing different sized nanobubbles that were exposed to shock waves propagating with different velocities were simulated. We observed creation of pores and damage to bilayers and also subsequent pore closing and the bilayer recovery after shock wave passed the bilayer. In all our systems where bilayers were damaged, they recovered; nevertheless we observed that a large amount of water crossed the pore that was temporarily created. We also observed that not every lipid molecule remained in the bilayer after recovery, some lipids moved out into water and created micelles. (C) 2014 AIP Publishing LLC.
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页数:9
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