Revisiting the hexane-water interface via molecular dynamics simulations using nonadditive alkane-water potentials (Q46520540)

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scientific article published in May 2006

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English	Revisiting the hexane-water interface via molecular dynamics simulations using nonadditive alkane-water potentials	scientific article published in May 2006

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instance of

scholarly article

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

title

Revisiting the hexane-water interface via molecular dynamics simulations using nonadditive alkane-water potentials (English)

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

main subject

alkane

0 references

author name string

Sandeep A Patel

series ordinal

1

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

Charles L Brooks

series ordinal

2

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

language of work or name

English

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publication date

1 May 2006

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stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

published in

Journal of Chemical Physics

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

volume

124

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

issue

20

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

page(s)

204706

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

cites work

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21 January 2018

Molecular simulations of liquid-liquid interfacial properties: water-n-alkane and water-methanol-n-alkane systems.

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21 January 2018

Molecular dynamics study of the n-hexane-water interface: towards a better understanding of the liquid-liquid interfacial broadening

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21 January 2018

Structure, thermodynamics, and liquid-vapor equilibrium of ethanol from molecular-dynamics simulations using nonadditive interactions

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21 January 2018

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Proton transport across transient single-file water pores in a lipid membrane studied by molecular dynamics simulations

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Magnitude of the solvation pressure depends on dipole potential

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A molecular dynamics study of the response of lipid bilayers and monolayers to trehalose

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Surface properties probed by second-harmonic and sum-frequency generation

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Computer simulation and the dielectric constant of polarizable polar systems

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Determination of Electrostatic Parameters for a Polarizable Force Field Based on the Classical Drude Oscillator

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Polarizable Empirical Force Field for Alkanes Based on the Classical Drude Oscillator Model

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An ab Initio Study on the Torsional Surface of Alkanes and Its Effect on Molecular Simulations of Alkanes and a DPPC Bilayer

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A simple polarizable model of water based on classical Drude oscillators

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Computer simulation study of the interface width of the liquid/liquid interface

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An Interpretation of Bond Lengths and a Classification of Bonds

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Fluctuating charge normal modes: An algorithm for implementing molecular dynamics simulations with polarizable potentials

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21 January 2018

Identifiers

DOI

10.1063/1.2198538

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

PubMed publication ID

16774363

1 reference

stated in

Europe PubMed Central

PubMed publication ID

16774363

retrieved

22 December 2017

reference URL

http://europepmc.org/abstract/MED/16774363

 

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