scholarly journals Using Molecular Dynamics to Gain Atomic-Level Insight into Bilayer Properties Measured with NMR and Neutron Spin-Echo Spectroscopy

2021 ◽  
Vol 120 (3) ◽  
pp. 224a-225a
Author(s):  
Milka Doktorova ◽  
George Khelashvili ◽  
Trivikram R. Molugu ◽  
Rana Ashkar ◽  
Michael F. Brown
Keyword(s):  
Molecular Dynamics ◽  
Spin Echo ◽  
Atomic Level ◽  
Neutron Spin ◽  
Neutron Spin Echo ◽  
Insight Into

Water Dynamics in Hectorite Clays: Infuence of Temperature Studied by Coupling Neutron Spin Echo and Molecular Dynamics

2011 ◽  
Vol 45 (7) ◽  
pp. 2850-2855 ◽  
Author(s):  
Virginie Marry ◽  
Emmanuelle Dubois ◽  
Natalie Malikova ◽  
Serge Durand-Vidal ◽  
Stéphane Longeville ◽  
...  
Keyword(s):  
Molecular Dynamics ◽  
Spin Echo ◽  
Water Dynamics ◽  
Neutron Spin ◽  
Neutron Spin Echo

scholarly journals Structural and mechanical properties of cardiolipin lipid bilayers determined using neutron spin echo, small angle neutron and X-ray scattering, and molecular dynamics simulations

Soft Matter ◽  
2015 ◽  
Vol 11 (1) ◽  
pp. 130-138 ◽  
Author(s):  
Jianjun Pan ◽  
Xiaolin Cheng ◽  
Melissa Sharp ◽  
Chian-Sing Ho ◽  
Nawal Khadka ◽  
...  
Keyword(s):  
Mechanical Properties ◽  
Molecular Dynamics ◽  
Lipid Bilayers ◽  
Spin Echo ◽  
Neutron Spin ◽  
Computational Approaches ◽  
X Ray ◽  
Neutron Spin Echo ◽  
X Ray Scattering ◽  
Dynamics Simulations

Determining structural and mechanical properties of cardiolipin lipid bilayers using a multitude of experimental and computational approaches.

Diffusion of Isobutane in Silicalite: A Neutron Spin–Echo and Molecular Dynamics Simulation Study

2015 ◽  
Vol 119 (48) ◽  
pp. 26999-27006 ◽  
Author(s):  
Alexander J. O’Malley ◽  
C. Richard A. Catlow ◽  
Michael Monkenbusch ◽  
Hervé Jobic
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Simulation Study ◽  
Spin Echo ◽  
Dynamics Simulation ◽  
Neutron Spin ◽  
Neutron Spin Echo
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