Notes on the Treatment of Charged Particles for Studying Cyclotide/Membrane Interactions with Dissipative Particle Dynamics

Notes on the Treatment of Charged Particles for Studying Cyclotide/Membrane Interactions with Dissipative Particle Dynamics

Different charge treatment approaches are examined for cyclotide-induced plasma membrane disruption by lipid extraction studied with dissipative particle dynamics. A pure Coulomb approach with truncated forces tuned to avoid individual strong ion pairing still reveals hidden statistical pairing effe...

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Bibliographic Details
Main Authors: Felix Bänsch, Christoph Steinbeck, Achim Zielesny
Format: Article
Language:English
Published: MDPI AG 2022-06-01
Series:Membranes
Subjects:
cyclotide
biological membrane
plasma membrane
membrane disruption
electrostatic interaction
charge
Online Access:https://www.mdpi.com/2077-0375/12/6/619

Internet

https://www.mdpi.com/2077-0375/12/6/619

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