Simulations of nanopore formation and phosphatidylserine externalization in lipid membranes subjected to a high-intensity, ultrashort electric pulse.
A combined MD simulator and time dependent Laplace solver are used to analyze the electrically driven phosphatidylserine externalization process in cells. Time dependent details of nanopore formation at cell membranes in response to a high-intensity (100 kV/cm), ultrashort (10 ns) electric pulse are also probed. Our results show that nanosized pores could typically be formed within about 5 ns. These predictions are in very good agreement with recent experimental data. It is also demonstrated that defect formation and PS externalization in membranes should begin on the anode side. Finally, the simulations confirm that PS externalization is a nanopore facilitated event, rather than the result of molecular translocation across the trans-membrane energy barrier.
Hu
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Department of Electrical and Computer Engineering, Old Dominion University, Norfolk, Virginia 23529-0246, USA.
Joshi
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RP
Schoenbach
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KH
D003198:Computer Simulation; D004058:Diffusion; D004574:Electromagnetic Fields; D018274:Electroporation / Q000379:methods*; D008051:Lipid Bilayers / Q000737:chemistry* / Q000528:radiation effects*; D008560:Membrane Fluidity / Q000528:radiation effects*; D008564:Membrane Potentials / Q000528:radiation effects; D008956:Models, Chemical; D008958:Models, Molecular; D049329:Nanostructures / Q000737:chemistry* / Q000528:radiation effects* / Q000648:ultrastructure; D010316:Particle Size; D010539:Permeability / Q000528:radiation effects; D010718:Phosphatidylserines / Q000737:chemistry* / Q000528:radiation effects; D016062:Porosity
D008051:Lipid Bilayers; D010718:Phosphatidylserines