Self-assembly of a patterned hydrophobic-hydrophilic surface by soft segment microphase separation in a segmented polyurethane: Combined experimental study and molecular dynamics simulation

Polymer ◽

10.1016/j.polymer.2020.122424 ◽

2020 ◽

Vol 195 ◽

pp. 122424 ◽

Cited By ~ 3

Author(s):

Helma Vakili ◽

Mohsen Mohseni ◽

Hesam Makki ◽

Hossein Yahyaei ◽

Hossein Ghanbari ◽

...

Keyword(s):

Molecular Dynamics ◽

Experimental Study ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

Microphase Separation ◽

Soft Segment ◽

Dynamics Simulation ◽

Hydrophilic Surface ◽

Segmented Polyurethane

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Corrosion mechanism of sulfate, chloride, and tetrafluoroborate ions interacted with Ni-19 wt% Cr coating: A combined experimental study and molecular dynamics simulation

Journal of Molecular Liquids ◽

10.1016/j.molliq.2020.114243 ◽

2020 ◽

Vol 319 ◽

pp. 114243 ◽

Cited By ~ 1

Author(s):

Zhina Razaghi ◽

Milad Rezaei

Keyword(s):

Molecular Dynamics ◽

Experimental Study ◽

Molecular Dynamics Simulation ◽

Dynamics Simulation ◽

Corrosion Mechanism ◽

Cr Coating

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Molecular Dynamics Simulation and Thermodynamic Modeling of the Self-Assembly of the Triterpenoids Asiatic Acid and Madecassic Acid in Aqueous Solution

The Journal of Physical Chemistry B ◽

10.1021/jp074310g ◽

2008 ◽

Vol 112 (8) ◽

pp. 2357-2371 ◽

Cited By ~ 13

Author(s):

Brian C. Stephenson ◽

Arthur Goldsipe ◽

Daniel Blankschtein

Keyword(s):

Molecular Dynamics ◽

Aqueous Solution ◽

Molecular Dynamics Simulation ◽

Thermodynamic Modeling ◽

Self Assembly ◽

The Self ◽

Dynamics Simulation ◽

Asiatic Acid

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Large scale molecular dynamics simulation of self-assembly processes in short and long chain cationic surfactants

Physical Chemistry Chemical Physics ◽

10.1039/a905216j ◽

1999 ◽

Vol 1 (23) ◽

pp. 5277-5290 ◽

Cited By ~ 90

Author(s):

J.-B. Maillet ◽

V. Lachet ◽

Peter V. Coveney

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

Cationic Surfactants ◽

Large Scale ◽

Dynamics Simulation ◽

Long Chain

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Combination of molecular dynamics simulation, COSMO-RS, and experimental study to understand extraction of naphthenic acid

Separation and Purification Technology ◽

10.1016/j.seppur.2021.119810 ◽

2022 ◽

Vol 280 ◽

pp. 119810

Author(s):

Plácido Arenas ◽

Inmaculada Suárez ◽

Baudilio Coto

Keyword(s):

Molecular Dynamics ◽

Experimental Study ◽

Molecular Dynamics Simulation ◽

Naphthenic Acid ◽

Dynamics Simulation

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New detailed insights on the role of a novel praseodymium nanofilm on the polymer/steel interfacial adhesion bonds in dry and wet conditions: An integrated molecular dynamics simulation and experimental study

Journal of the Taiwan Institute of Chemical Engineers ◽

10.1016/j.jtice.2018.01.013 ◽

2018 ◽

Vol 85 ◽

pp. 221-236 ◽

Cited By ~ 21

Author(s):

Ghasem Bahlakeh ◽

Bahram Ramezanzadeh ◽

Mohammad Ramezanzadeh

Keyword(s):

Molecular Dynamics ◽

Experimental Study ◽

Molecular Dynamics Simulation ◽

Interfacial Adhesion ◽

Dynamics Simulation ◽

Dry And Wet Conditions

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Molecular insights into the self-assembly of short amphiphilic peptides FmDn and FmKn

RSC Advances ◽

10.1039/c4ra10571k ◽

2014 ◽

Vol 4 (105) ◽

pp. 60741-60748 ◽

Cited By ~ 6

Author(s):

Naresh Thota ◽

Yijia Ma ◽

Jianwen Jiang

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

The Self ◽

Dynamics Simulation ◽

Amphiphilic Peptides

Molecular dynamics simulation is reported for the self-assembly of short amphiphilic peptides FmDn and FmKn.

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Self-assembly of 50 bp poly(dA)·poly(dT) DNA on highly oriented pyrolytic graphite via atomic force microscopy observation and molecular dynamics simulation

The Journal of Chemical Physics ◽

10.1063/1.4818595 ◽

2013 ◽

Vol 139 (8) ◽

pp. 085102 ◽

Cited By ~ 9

Author(s):

Kentaro Doi ◽

Hiroshi Takeuchi ◽

Ryosuke Nii ◽

Shingo Akamatsu ◽

Toshiya Kakizaki ◽

...

Keyword(s):

Molecular Dynamics ◽

Atomic Force Microscopy ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

Pyrolytic Graphite ◽

Dynamics Simulation ◽

Microscopy Observation ◽

Force Microscopy ◽

Atomic Force ◽

Atomic Force Microscopy Observation

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The self-assembly mechanism of tetra-peptides from the motif of β-amyloid peptides: a combined coarse-grained and all-atom molecular dynamics simulation

RSC Advances ◽

10.1039/c6ra18204f ◽

2016 ◽

Vol 6 (102) ◽

pp. 100072-100078 ◽

Cited By ~ 4

Author(s):

Lijun Liang ◽

Li-Wei Wang ◽

Jia-Wei Shen

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

The Self ◽

Dynamics Simulation ◽

Coarse Grained ◽

Aβ Peptides ◽

Amyloid Peptides ◽

Assembly Mechanism ◽

Β Amyloid

Understanding the self-assembly mechanisms of tetra-peptides from Aβ-peptides into different nanostructures.

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Molecular Dynamics Simulation of Nanoparticle Self-Assembly at a Liquid−Liquid Interface

Langmuir ◽

10.1021/la0607196 ◽

2006 ◽

Vol 22 (14) ◽

pp. 6385-6390 ◽

Cited By ~ 47

Author(s):

Mingxiang Luo ◽

Oleg A. Mazyar ◽

Qing Zhu ◽

Mark W. Vaughn ◽

William L. Hase ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

Liquid Interface ◽

Dynamics Simulation

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Investigation of the self-assembly of CS and PCL copolymers with different molecular weights in water solution by coarse-grained molecular dynamics simulation

Journal of Molecular Modeling ◽

10.1007/s00894-017-3294-z ◽

2017 ◽

Vol 23 (5) ◽

Cited By ~ 4

Author(s):

Chun-Yi Chang ◽

Shin-Pon Ju ◽

Li-Fang Wang ◽

Chien-Chia Chen ◽

Ying-Chen Chuang ◽

...

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Self Assembly ◽

Water Solution ◽

The Self ◽

Dynamics Simulation ◽

Coarse Grained ◽

Molecular Weights ◽

Coarse Grained Molecular Dynamics

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