Molecular association between water and dimethyl sulfoxide in solution: A molecular dynamics simulation study

1999 ◽  
Vol 110 (13) ◽  
pp. 6412-6420 ◽  
Author(s):  
Ivana A. Borin ◽  
Munir S. Skaf
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Dimethyl Sulfoxide ◽  
Simulation Study ◽  
Molecular Association ◽  
Dynamics Simulation

Solvation of cholesterol in different solvents: a molecular dynamics simulation study

2020 ◽  
Vol 22 (3) ◽  
pp. 1154-1167 ◽  
Author(s):  
Khair Bux ◽  
Syed Tarique Moin
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Molecular Dynamics Simulations ◽  
Dimethyl Sulfoxide ◽  
Simulation Study ◽  
Dynamics Simulation ◽  
Dynamical Properties ◽  
Dynamics Simulations

Molecular dynamics simulations were applied to an isolated cholesterol immersed in four different solvents of varying polarity, such as water, methanol, dimethyl sulfoxide and benzene, to gain insights into the structural and dynamical properties.

scholarly journals Solubility temperature and solvent dependence and preferential solvation of citrus flavonoid naringin in aqueous DMSO mixtures: an experimental and molecular dynamics simulation study

RSC Advances ◽  
2017 ◽  
Vol 7 (24) ◽  
pp. 14776-14789 ◽  
Author(s):  
Morteza Jabbari ◽  
Negar Khosravi ◽  
Mina Feizabadi ◽  
Davood Ajloo
Keyword(s):  
Molecular Dynamics ◽  
Molecular Dynamics Simulation ◽  
Aqueous Solutions ◽  
Dimethyl Sulfoxide ◽  
Simulation Study ◽  
Atmospheric Pressure ◽  
Preferential Solvation ◽  
Dynamics Simulation ◽  
Solvent Dependence ◽  
Thermodynamics Of Dissolution

This study describes the thermodynamics of dissolution of flavonoid naringin in different aqueous solutions of dimethyl sulfoxide (DMSO) containing 0–100% (w/w) under atmospheric pressure and over a temperature range of 298.15 to 325.15 K.

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