Effect of Saturated Very Long-Chain Fatty Acids on the Organization of Lipid Membranes: A Study Combining 2H NMR Spectroscopy and Molecular Dynamics Simulations

2016 ◽  
Vol 120 (28) ◽  
pp. 6951-6960 ◽  
Author(s):  
Adrian Paz Ramos ◽  
Patrick Lagüe ◽  
Guillaume Lamoureux ◽  
Michel Lafleur
Keyword(s):  
Molecular Dynamics ◽  
Fatty Acids ◽  
Nmr Spectroscopy ◽  
Molecular Dynamics Simulations ◽  
Lipid Membranes ◽  
2H Nmr ◽  
Long Chain Fatty Acids ◽  
2H Nmr Spectroscopy ◽  
Dynamics Simulations ◽  
Long Chain

Interactions of Long-Chain Polyamines with Silica Studied by Molecular Dynamics Simulations and Solid-State NMR Spectroscopy

Langmuir ◽  
2020 ◽  
Vol 36 (39) ◽  
pp. 11600-11609
Author(s):  
Maria Montagna ◽  
Stephan Ingmar Brückner ◽  
Arezoo Dianat ◽  
Rafael Gutierrez ◽  
Fabian Daus ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Solid State ◽  
Nmr Spectroscopy ◽  
Molecular Dynamics Simulations ◽  
Solid State Nmr ◽  
Solid State Nmr Spectroscopy ◽  
Dynamics Simulations ◽  
Long Chain

Direct observation of long chain enrichment in flow-induced nuclei from molecular dynamics simulations of bimodal blends

Soft Matter ◽  
2021 ◽  
Vol 17 (10) ◽  
pp. 2872-2882
Author(s):  
Muhammad Anwar ◽  
Richard S. Graham
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Direct Observation ◽  
Dynamics Simulations ◽  
Long Chain ◽  
Long Chains

Modelling of flow-induced nucleation in polymers suggest that long chains are enriched in nuclei, relative to their melt concentration.

scholarly journals Variable tilt on lipid membranes

2014 ◽  
Vol 470 (2172) ◽  
pp. 20140463 ◽  
Author(s):  
P. Rangamani ◽  
D. J. Steigmann
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulations ◽  
Lipid Membranes ◽  
Continuum Theory ◽  
Linear Version ◽  
Dynamics Simulations ◽  
Membrane Shape ◽  
Planar Membranes

A continuum theory for lipid membranes is developed that accounts for mechanical interactions between lipid tilt and membrane shape. For planar membranes, a linear version of the theory is used to predict tilt variations similar to those observed in experiments and molecular dynamics simulations.

scholarly journals Molecular dynamics simulations of carbon nanotube porins in lipid bilayers

2018 ◽  
Vol 209 ◽  
pp. 341-358 ◽  
Author(s):  
Martin Vögele ◽  
Jürgen Köfinger ◽  
Gerhard Hummer
Keyword(s):  
Molecular Dynamics ◽  
Carbon Nanotube ◽  
Molecular Dynamics Simulations ◽  
Lipid Bilayers ◽  
Lipid Membranes ◽  
Dynamics Simulations

Carbon nanotube porins embedded in lipid membranes are studied by molecular dynamics simulations.

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