Conformations and Chain Dimensions of Poly(ethylene oxide) in Aqueous Solution: A Molecular Dynamics Simulation Study

Grant D. Smith; Dmitry Bedrov; Oleg Borodin

doi:10.1021/ja001053j

Conformations and Chain Dimensions of Poly(ethylene oxide) in Aqueous Solution: A Molecular Dynamics Simulation Study

Journal of the American Chemical Society ◽

10.1021/ja001053j ◽

2000 ◽

Vol 122 (39) ◽

pp. 9548-9549 ◽

Cited By ~ 56

Author(s):

Grant D. Smith ◽

Dmitry Bedrov ◽

Oleg Borodin

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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The influence of polymer architecture on the assembly of poly(ethylene oxide) grafted C60 fullerene clusters in aqueous solution: a molecular dynamics simulation study

Physical Chemistry Chemical Physics ◽

10.1039/b818971d ◽

2009 ◽

Vol 11 (12) ◽

pp. 2034 ◽

Cited By ~ 8

Author(s):

Justin B. Hooper ◽

Dmitry Bedrov ◽

Grant D. Smith

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

C60 Fullerene ◽

Poly Ethylene Oxide ◽

Poly Ethylene ◽

Fullerene Clusters

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Molecular Dynamics Simulation Study of the Structure of Poly(ethylene oxide) Brushes on Nonpolar Surfaces in Aqueous Solution

Langmuir ◽

10.1021/la060535r ◽

2006 ◽

Vol 22 (14) ◽

pp. 6189-6194 ◽

Cited By ~ 29

Author(s):

Dmitry Bedrov ◽

Grant D. Smith

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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Glass transition in single poly(ethylene oxide) chain: A molecular dynamics simulation study

Journal of Polymer Science Part B Polymer Physics ◽

10.1002/polb.24255 ◽

2016 ◽

Vol 55 (2) ◽

pp. 178-188 ◽

Cited By ~ 12

Author(s):

Chaofu Wu

Keyword(s):

Molecular Dynamics ◽

Glass Transition ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Ethylene Oxide Chain ◽

Poly Ethylene

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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 ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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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 ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Dynamics Simulation ◽

Dilute Aqueous Solution ◽

Poly Ethylene Oxide ◽

Polar Interactions ◽

Poly Ethylene

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A Molecular Dynamics Simulation Study of Polymer Dynamics in Aqueous Poly(ethylene oxide) Solutions

Macromolecules ◽

10.1021/ma010038b ◽

2001 ◽

Vol 34 (16) ◽

pp. 5687-5693 ◽

Cited By ~ 21

Author(s):

Oleg Borodin ◽

Dmitry Bedrov ◽

Grant D. Smith

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Polymer Dynamics ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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Molecular Dynamics Simulation Study of Dielectric Relaxation in Aqueous Poly(ethylene oxide) Solutions

Macromolecules ◽

10.1021/ma011361h ◽

2002 ◽

Vol 35 (6) ◽

pp. 2410-2412 ◽

Cited By ~ 17

Author(s):

Oleg Borodin ◽

Dmitry Bedrov ◽

Grant D. Smith

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Dielectric Relaxation ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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Molecular Dynamics Simulation Study of LiI-Doped Diglyme and Poly(ethylene oxide) Solutions

The Journal of Physical Chemistry B ◽

10.1021/jp0011443 ◽

2000 ◽

Vol 104 (33) ◽

pp. 8017-8022 ◽

Cited By ~ 21

Author(s):

Oleg Borodin ◽

Grant D. Smith

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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Molecular Dynamics Simulation Study of the Role of Evenly Spaced Poly(ethylene oxide) Tethers on the Aggregation of C60Fullerenes in Water

Langmuir ◽

10.1021/la0504816 ◽

2005 ◽

Vol 21 (12) ◽

pp. 5251-5255 ◽

Cited By ~ 32

Author(s):

Dmitry Bedrov ◽

Grant D. Smith ◽

Liwei Li

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Simulation Study ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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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 ◽

Molecular Dynamics Simulation ◽

Ethylene Oxide ◽

Ion Transport ◽

Polymer Electrolyte ◽

Crystalline Polymer ◽

Dynamics Simulation ◽

Poly Ethylene Oxide ◽

Poly Ethylene

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