Molecular dynamics simulations of phase separation in porous media

1995 ◽  
Vol 28 (14) ◽  
pp. L403-L408 ◽  
Author(s):  
B Strickland ◽  
G Leptoukh ◽  
C Roland
Keyword(s):  
Molecular Dynamics ◽  
Porous Media ◽  
Phase Separation ◽  
Molecular Dynamics Simulations ◽  
Dynamics Simulations

scholarly journals The influence of motility on bacterial accumulation in a microporous channel

Soft Matter ◽  
2021 ◽  
Author(s):  
Miru Lee ◽  
Christoph Lohrmann ◽  
Kai Szuttor ◽  
Harold Auradou ◽  
Christian Holm
Keyword(s):  
Molecular Dynamics ◽  
Porous Media ◽  
Molecular Dynamics Simulations ◽  
Lattice Boltzmann ◽  
Square Channel ◽  
Cylindrical Obstacle ◽  
Bacterial Accumulation ◽  
Dynamics Simulations ◽  
Transport Of Bacteria

We study the transport of bacteria in a porous media modeled by a square channel containing one cylindrical obstacle via molecular dynamics simulations coupled to a lattice Boltzmann fluid.

In silico phase separation in the presence of GM1 in ternary and quaternary lipid bilayers

2015 ◽  
Vol 17 (26) ◽  
pp. 17130-17139 ◽  
Author(s):  
Ipsita Basu ◽  
Chaitali Mukhopadhyay
Keyword(s):  
Molecular Dynamics ◽  
Phase Separation ◽  
Molecular Dynamics Simulations ◽  
Lipid Bilayers ◽  
In Silico ◽  
Coarse Grain ◽  
Liquid Ordered ◽  
Dynamics Simulations ◽  
Self Aggregation ◽  
Spontaneous Phase

Using coarse grain molecular dynamics simulations, the spontaneous phase separation in the ternary (POPC [1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine]/cholesterol/GM1) and quaternary (POPC/PSM[palmitoyl sphingomyelin]/cholesterol/GM1) lipid bilayers into liquid ordered (Lo) and liquid disordered (Ld) domains, due to self-aggregation of GM1 molecules and co-localization of cholesterol with GM1 in accordance with experiments, is studied.

scholarly journals Imaging phase separation in model lipid membranes through the use of BODIPY based molecular rotors

2015 ◽  
Vol 17 (28) ◽  
pp. 18393-18402 ◽  
Author(s):  
Michael R. Dent ◽  
Ismael López-Duarte ◽  
Callum J. Dickson ◽  
Niall D. Geoghegan ◽  
Jonathan M. Cooper ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Phase Separation ◽  
Fluorescence Spectroscopy ◽  
Molecular Dynamics Simulations ◽  
Lipid Bilayers ◽  
Lipid Membranes ◽  
Molecular Rotors ◽  
Model Lipid Membranes ◽  
Dynamics Simulations

Viscosity in the phase-separated lipid bilayers is investigated through the use of fluorescence spectroscopy and molecular dynamics simulations.

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