Computer Modeling of Skin Barrier Lipid Layers by Molecular Dynamics

2001 ◽  
pp. 75-96
Author(s):  
Monika Höltje
Keyword(s):  
Molecular Dynamics ◽  
Computer Modeling ◽  
Skin Barrier ◽  
Lipid Layers

scholarly journals Structural modification of the skin barrier by OH radicals: a reactive molecular dynamics study for plasma medicine

2015 ◽  
Vol 48 (15) ◽  
pp. 155202 ◽  
Author(s):  
J Van der Paal ◽  
C C Verlackt ◽  
M Yusupov ◽  
E C Neyts ◽  
A Bogaerts
Keyword(s):  
Molecular Dynamics ◽  
Structural Modification ◽  
Skin Barrier ◽  
Oh Radicals ◽  
Plasma Medicine ◽  
Reactive Molecular Dynamics

Computer Modeling of the Properties of Carbon Nanotubes and Composite Materials

2008 ◽  
Author(s):  
L. V. Bochkareva ◽  
D. M. Sanikovich
Keyword(s):  
Thermal Conductivity ◽  
Carbon Nanotubes ◽  
Molecular Dynamics ◽  
Composite Materials ◽  
Finite Elements ◽  
Computer Modeling ◽  
Finite Elements Method ◽  
Case Tools ◽  
Method Of Molecular Dynamics ◽  
The Creation

The paper is devoted to the modeling of thermal conductivity of carbon nanotubes, damping and elasticity of composite materials. In work the researches are carried out on the basis of the method of molecular dynamics and the finite elements method. The creation of the software with the help of CASE-tools is carried out.

Study of PEGylated Lipid Layers as a Model for PEGylated Liposome Surfaces: Molecular Dynamics Simulation and Langmuir Monolayer Studies

Langmuir ◽  
2011 ◽  
Vol 27 (12) ◽  
pp. 7788-7798 ◽  
Author(s):  
Michał Stepniewski ◽  
Marta Pasenkiewicz-Gierula ◽  
Tomasz Róg ◽  
Reinis Danne ◽  
Adam Orlowski ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Langmuir Monolayer ◽  
Dynamics Simulation ◽  
Pegylated Liposome ◽  
Lipid Layers

Interaction of O and OH radicals with a simple model system for lipids in the skin barrier: a reactive molecular dynamics investigation for plasma medicine

2013 ◽  
Vol 46 (39) ◽  
pp. 395201 ◽  
Author(s):  
Jonas Van der Paal ◽  
Stefaan Aernouts ◽  
Adri C T van Duin ◽  
Erik C Neyts ◽  
Annemie Bogaerts
Keyword(s):  
Molecular Dynamics ◽  
Simple Model ◽  
Skin Barrier ◽  
Model System ◽  
Oh Radicals ◽  
Plasma Medicine ◽  
Reactive Molecular Dynamics ◽  
Simple Model System
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