Effect of Temperature, Pressure, and Cosolvents on Structural and Dynamic Properties of the Hydration Shell of SNase:  A Molecular Dynamics Computer Simulation Study

2008 ◽  
Vol 112 (3) ◽  
pp. 997-1006 ◽  
Author(s):  
Nikolai Smolin ◽  
Roland Winter
Keyword(s):  
Molecular Dynamics ◽  
Computer Simulation ◽  
Simulation Study ◽  
Dynamic Properties ◽  
Hydration Shell ◽  
Effect Of Temperature ◽  
Computer Simulation Study

Computer simulation study of fluorocarbon phosphate surfactant based aqueous reverse micelle in supercritical CO2: roles of surfactant functional groups, ionic strength, and phase changes in CO2

2020 ◽  
Vol 22 (6) ◽  
pp. 3434-3445 ◽  
Author(s):  
Youngseon Shim
Keyword(s):  
Carbon Dioxide ◽  
Molecular Dynamics ◽  
Computer Simulation ◽  
Ionic Strength ◽  
Computer Simulations ◽  
Simulation Study ◽  
Supercritical Co2 ◽  
Dynamic Properties ◽  
Phase Changes ◽  
Computer Simulation Study

Structural and dynamic properties of an aqueous micelle organized from fluorocarbon phosphate surfactant molecules in supercritical carbon dioxide are investigated via molecular dynamics computer simulations.

Mechanisms of Focusing in Sputtering: Molecular Dynamics Computer Simulation Study

1996 ◽  
pp. 710-714 ◽  
Author(s):  
V.N. Samoilov ◽  
O.S. Korsakova ◽  
E.L. Rodionova ◽  
A.M. Nikitin ◽  
V.I. Bachurin
Keyword(s):  
Molecular Dynamics ◽  
Computer Simulation ◽  
Simulation Study ◽  
Computer Simulation Study

A molecular dynamics computer simulation study of the hydration of bis(methylsulphonyl)methane in water

1985 ◽  
Vol 56 (6) ◽  
pp. 1393-1409 ◽  
Author(s):  
Klaas Remerie ◽  
Wilfred F. van Gunsteren ◽  
Jan B.F.N. Engberts
Keyword(s):  
Molecular Dynamics ◽  
Computer Simulation ◽  
Simulation Study ◽  
Computer Simulation Study
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