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Hydrodynamic coupling for particle-based solvent-free membrane models
- Source :
- The Journal of Chemical Physics. 155:114108
- Publication Year :
- 2021
- Publisher :
- AIP Publishing, 2021.
-
Abstract
- The great challenge with biological membrane systems is the wide range of scales involved, from nanometers and picoseconds for individual lipids, to the micrometers and beyond millisecond for cellular signalling processes. While solvent-free coarse-grained membrane models are convenient for large-scale simulations, and promising to provide insight into slow processes involving membranes, these models usually have unrealistic kinetics. One major obstacle is the lack of an equally convenient way of introducing hydrodynamic coupling without significantly increasing the computational cost of the model. To address this, we introduce a framework based on anisotropic Langevin dynamics, for which major in-plane and out-of-plane hydrodynamic effects are modeled via friction and diffusion tensors from analytical or semi-analytical solutions to Stokes hydrodynamic equations. Using this framework, we obtain accurate dispersion relations for planar membrane patches, both free-standing and in the vicinity of a wall. We also briefly discuss how non-equilibrium dynamics is affected by hydrodynamic interactions.<br />Submitted to The Journal of Chemical Physics
- Subjects :
- FOS: Physical sciences
General Physics and Astronomy
01 natural sciences
Diffusion
03 medical and health sciences
Dispersion relation
0103 physical sciences
Physics - Biological Physics
Physical and Theoretical Chemistry
Diffusion (business)
Langevin dynamics
030304 developmental biology
Coupling
Physics
0303 health sciences
010304 chemical physics
Viscosity
Cell Membrane
Fluid Dynamics (physics.flu-dyn)
Biological membrane
Physics - Fluid Dynamics
Mechanics
Computational Physics (physics.comp-ph)
Membrane
Biological Physics (physics.bio-ph)
Hydrodynamics
Solvents
Dissipative system
Particle
Physics - Computational Physics
Subjects
Details
- ISSN :
- 10897690 and 00219606
- Volume :
- 155
- Database :
- OpenAIRE
- Journal :
- The Journal of Chemical Physics
- Accession number :
- edsair.doi.dedup.....04effbfb109c3fc2d0e854afcb5ee657