Improving the Accuracy of Molecular Dynamics Simulation of Poly Ethylene Oxide

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Ethylene Oxide Chain ◽

Molecular dynamics simulation of polymer-coupled ion transport in the crystalline polymer electrolyte poly(ethylene oxide)3:NaI

Polymer ◽

10.1016/j.polymer.2018.09.024 ◽

2018 ◽

Vol 155 ◽

pp. 136-145

Author(s):

Ramesh Cheerla ◽

Marimuthu Krishnan

Keyword(s):

Molecular Dynamics ◽

Ethylene Oxide ◽

Ion Transport ◽

Polymer Electrolyte ◽

Crystalline Polymer ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Molecular dynamics simulation of crystalline poly(ethylene oxide)

The Journal of Chemical Physics ◽

10.1063/1.467995 ◽

1994 ◽

Vol 101 (11) ◽

pp. 10064-10073 ◽

Cited By ~ 72

Author(s):

Sylvie Neyertz ◽

David Brown ◽

John O. Thomas

Keyword(s):

Molecular Dynamics ◽

Ethylene Oxide ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Application of Molecular Dynamics Simulation To Predict the Compatability between Water-Insoluble Drugs and Self-Associating Poly(ethylene oxide)-b-poly(ε-caprolactone) Block Copolymers

Biomacromolecules ◽

10.1021/bm800320z ◽

2008 ◽

Vol 9 (11) ◽

pp. 3014-3023 ◽

Cited By ~ 63

Author(s):

Sarthak Patel ◽

Afsaneh Lavasanifar ◽

Phillip Choi

Keyword(s):

Molecular Dynamics ◽

Block Copolymers ◽

Ethylene Oxide ◽

Dynamics Simulation ◽

Insoluble Drugs ◽

Poly Ethylene Oxide ◽

Prediction of the solubility of cucurbitacin drugs in self-associating poly(ethylene oxide)-b-poly(α-benzyl carboxylate ɛ-caprolactone) block copolymer with different tacticities using molecular dynamics simulation

Biomaterials ◽

10.1016/j.biomaterials.2009.09.051 ◽

2010 ◽

Vol 31 (2) ◽

pp. 345-357 ◽

Cited By ~ 31

Author(s):

Sarthak K. Patel ◽

Afsaneh Lavasanifar ◽

Phillip Choi

Keyword(s):

Molecular Dynamics ◽

Block Copolymer ◽

Ethylene Oxide ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Molecular dynamics simulation of polymer electrolytes based on poly(ethylene oxide) and ionic liquids. II. Dynamical properties

The Journal of Chemical Physics ◽

10.1063/1.2798759 ◽

2007 ◽

Vol 127 (16) ◽

pp. 164901 ◽

Cited By ~ 34

Author(s):

Luciano T. Costa ◽

Mauro C. C. Ribeiro

Keyword(s):

Molecular Dynamics ◽

Ionic Liquids ◽

Ethylene Oxide ◽

Polymer Electrolytes ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Dynamical Properties ◽

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 ◽

Cited By ~ 76

Author(s):

Barry Z. Shang ◽

Zuowei Wang ◽

Ronald G. Larson

Keyword(s):

Molecular Dynamics ◽

Sodium Dodecyl Sulfate ◽

Ethylene Oxide ◽

Sodium Dodecyl ◽

Dynamics Simulation ◽

Sodium Dodecyl Sulfate Micelle ◽

Dodecyl Sulfate ◽

Poly Ethylene Oxide ◽

Molecular Dynamics Simulation Study of Hydrogen Bonding in Aqueous Poly(Ethylene Oxide) Solutions

Physical Review Letters ◽

10.1103/physrevlett.85.5583 ◽

2000 ◽

Vol 85 (26) ◽

pp. 5583-5586 ◽

Cited By ~ 79

Author(s):

Grant D. Smith ◽

Dmitry Bedrov ◽

Oleg Borodin

Keyword(s):

Molecular Dynamics ◽

Hydrogen Bonding ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Molecular dynamics simulation of the polymer electrolyte poly(ethylene oxide)/LiClO4. II. Dynamical properties

The Journal of Chemical Physics ◽

10.1063/1.2400221 ◽

2006 ◽

Vol 125 (21) ◽

pp. 214903 ◽

Cited By ~ 32

Author(s):

Leonardo J. A. Siqueira ◽

Mauro C. C. Ribeiro

Keyword(s):

Molecular Dynamics ◽

Ethylene Oxide ◽

Polymer Electrolyte ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Dynamical Properties ◽

A Molecular Dynamics Simulation Study of the Influence of Hydrogen-Bonding and Polar Interactions on Hydration and Conformations of a Poly(ethylene oxide) Oligomer in Dilute Aqueous Solution

Macromolecules ◽

10.1021/ma011026t ◽

2002 ◽

Vol 35 (14) ◽

pp. 5712-5719 ◽

Cited By ~ 36

Author(s):

Grant D. Smith ◽

Dmitry Bedrov

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Hydrogen Bonding ◽

Ethylene Oxide ◽

Dynamics Simulation ◽

Dilute Aqueous Solution ◽

Poly Ethylene Oxide ◽

Polar Interactions ◽