Bioinspired Vesicles Encompassing Two-Tail Phospholipids: Self-Assembly and Phase Segregation via Implicit Solvent Coarse-Grained Molecular Dynamics

2014 ◽  
Vol 118 (29) ◽  
pp. 8614-8623 ◽  
Author(s):  
Fikret Aydin ◽  
Meenakshi Dutt
Keyword(s):  
Molecular Dynamics ◽  
Self Assembly ◽  
Phase Segregation ◽  
Coarse Grained ◽  
Implicit Solvent ◽  
Coarse Grained Molecular Dynamics

Coarse-grained simulation of the self-assembly of lipid vesicles concomitantly with novel block copolymers with multiple tails

Soft Matter ◽  
2021 ◽  
Author(s):  
Alexander Kantardjiev
Keyword(s):  
Molecular Dynamics ◽  
Block Copolymers ◽  
Self Assembly ◽  
Lipid Vesicles ◽  
The Self ◽  
Coarse Grained ◽  
Copolymer Concentration ◽  
Copolymer Structure ◽  
Coarse Grained Molecular Dynamics

We carried out a series of coarse-grained molecular dynamics liposome-copolymer simulations with varying extent of copolymer concentration in an attempt to understand the effect of copolymer structure and concentration on vesicle self-assembly and stability.

Coarse-grained molecular dynamics study on the self-assembly of Gemini surfactants: the effect of spacer length

2017 ◽  
Vol 19 (6) ◽  
pp. 4462-4468 ◽  
Author(s):  
Pan Wang ◽  
Shuai Pei ◽  
Muhan Wang ◽  
Youguo Yan ◽  
Xiaoli Sun ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Self Assembly ◽  
Gemini Surfactants ◽  
Molecular Level ◽  
Underlying Mechanism ◽  
The Self ◽  
Coarse Grained ◽  
Spacer Length ◽  
Coarse Grained Molecular Dynamics

This work provides a molecular-level understanding of the underlying mechanism of the self-assembly of Gemini surfactants.

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