Free energy of water permeation into hydrophobic core of sodium dodecyl sulfate micelle by molecular dynamics calculation

The Journal of Chemical Physics ◽

10.1063/1.2464000 ◽

2007 ◽

Vol 126 (9) ◽

pp. 096101 ◽

Author(s):

Noriyuki Yoshii ◽

Susumu Okazaki

Keyword(s):

Molecular Dynamics ◽

Free Energy ◽

Sodium Dodecyl Sulfate ◽

Sodium Dodecyl ◽

Hydrophobic Core ◽

Sodium Dodecyl Sulfate Micelle ◽

Water Permeation ◽

Dodecyl Sulfate ◽

Dynamics Calculation

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Molecular Dynamics Simulation of Pyrene Solubilized in a Sodium Dodecyl Sulfate Micelle

Langmuir ◽

10.1021/la300146s ◽

2012 ◽

Vol 28 (11) ◽

pp. 4931-4938 ◽

Author(s):

Hui Yan ◽

Peng Cui ◽

Cheng-Bu Liu ◽

Shi-Ling Yuan

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate

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Molecular dynamics simulation of removal of heavy metals with sodium dodecyl sulfate micelle in water

Colloids and Surfaces A Physicochemical and Engineering Aspects ◽

10.1016/j.colsurfa.2019.123613 ◽

2019 ◽

Vol 578 ◽

pp. 123613 ◽

Author(s):

Maria del Alba Pacheco-Blas ◽

Luis Vicente

Keyword(s):

Heavy Metals ◽

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate ◽

Removal Of Heavy Metals

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A molecular dynamics study of free energy of micelle formation for sodium dodecyl sulfate in water and its size distribution

The Journal of Chemical Physics ◽

10.1063/1.2179074 ◽

2006 ◽

Vol 124 (18) ◽

pp. 184901 ◽

Author(s):

Noriyuki Yoshii ◽

Kensuke Iwahashi ◽

Susumu Okazaki

Keyword(s):

Molecular Dynamics ◽

Free Energy ◽

Sodium Dodecyl Sulfate ◽

Size Distribution ◽

Sodium Dodecyl ◽

Micelle Formation ◽

Dodecyl Sulfate

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Molecular Dynamics Simulation of Interactions between a Sodium Dodecyl Sulfate Micelle and a Poly(Ethylene Oxide) Polymer

The Journal of Physical Chemistry B ◽

10.1021/jp0773841 ◽

2008 ◽

Vol 112 (10) ◽

pp. 2888-2900 ◽

Author(s):

Barry Z. Shang ◽

Zuowei Wang ◽

Ronald G. Larson

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Ethylene Oxide ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate ◽

Poly Ethylene Oxide ◽

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Free Energy Change of Micelle Formation for Sodium Dodecyl Sulfate from a Dispersed State in Solution to Complete Micelles along Its Aggregation Pathways Evaluated by Chemical Species Model Combined with Molecular Dynamics Calculations

Acta Physico-Chimica Sinica ◽

10.3866/pku.whxb201802271 ◽

2018 ◽

Vol 34 (10) ◽

pp. 1163-1170

Author(s):

Noriyuki YOSHII ◽

◽

Mika KOMORI ◽

Shinji KAWADA ◽

Hiroaki TAKABAYASHI ◽

...

Keyword(s):

Molecular Dynamics ◽

Free Energy ◽

Sodium Dodecyl Sulfate ◽

Sodium Dodecyl ◽

Chemical Species ◽

Micelle Formation ◽

Free Energy Change ◽

Energy Change ◽

Molecular Dynamics Calculations ◽

Dodecyl Sulfate

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Molecular Dynamics Simulation of Effect of Salt on the Compromise of Hydrophilic and Hydrophobic Interactions in Sodium Dodecyl Sulfate Micelle Solutions

Chinese Journal of Chemical Engineering ◽

10.1016/s1004-9541(08)60259-1 ◽

2009 ◽

Vol 17 (4) ◽

pp. 654-660 ◽

Author(s):

Jian GAO ◽

Ying REN ◽

Wei GE

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Hydrophobic Interactions ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate

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The role of 2-methyl-2, 4-pentanediol in sodium dodecyl sulfate micelle dissociation unveiled by dynamic light scattering and molecular dynamics simulations

Colloids and Surfaces B Biointerfaces ◽

10.1016/j.colsurfb.2013.10.023 ◽

2014 ◽

Vol 114 ◽

pp. 357-362 ◽

Author(s):

Guillaume Roussel ◽

Sarah L. Rouse ◽

Mark S.P. Sansom ◽

Catherine Michaux ◽

Eric A. Perpète

Keyword(s):

Molecular Dynamics ◽

Light Scattering ◽

Sodium Dodecyl Sulfate ◽

Dynamic Light Scattering ◽

Molecular Dynamics Simulations ◽

Sodium Dodecyl ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate ◽

Dynamics Simulations

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Molecular Dynamics Simulation Analysis of a Sodium Dodecyl Sulfate Micelle in Aqueous Solution: Decreased Fluidity of the Micelle Hydrocarbon Interior

The Journal of Physical Chemistry ◽

10.1021/j100007a011 ◽

1995 ◽

Vol 99 (7) ◽

pp. 1846-1855 ◽

Author(s):

Alexander D. MacKerell

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Simulation Analysis ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate

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Molecular Dynamics Simulation of Sodium Dodecyl Sulfate Micelle in Water: Micellar Structural Characteristics and Counterion Distribution

The Journal of Physical Chemistry B ◽

10.1021/jp013616z ◽

2002 ◽

Vol 106 (15) ◽

pp. 3788-3793 ◽

Author(s):

Chrystal D. Bruce ◽

Max L. Berkowitz ◽

Lalith Perera ◽

Malcolm D. E. Forbes

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Structural Characteristics ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate

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A coarse-grained molecular dynamics simulation of a sodium dodecyl sulfate micelle in aqueous solution

Colloids and Surfaces A Physicochemical and Engineering Aspects ◽

10.1016/j.colsurfa.2009.10.007 ◽

2009 ◽

Vol 352 (1-3) ◽

pp. 99-102 ◽

Author(s):

Seifollah Jalili ◽

Mojdeh Akhavan

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Sodium Dodecyl Sulfate ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Coarse Grained ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate ◽

Coarse Grained Molecular Dynamics

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