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1

Mean spherical approximation for the Yukawa fluid radial distribution function

Henderson, Douglas, Boda, Dezső

Journal:

Molecular Physics

Year:

2011

Language:

english

File:

PDF, 189 KB

english, 2011

2

Simulations of calcium channel block by trivalent cations: Gd3+ competes with permeant ions for the selectivity filter

Attila Malasics, Dezső Boda, Mónika Valiskó, Douglas Henderson, Dirk Gillespie

Journal:

Biochimica et Biophysica Acta (BBA) - Biomembranes

Year:

2010

Language:

english

File:

PDF, 641 KB

english, 2010

3

Synthetic Nanopores as a Test Case for Ion Channel Theories: The Anomalous Mole Fraction Effect without Single Filing

Gillespie, Dirk, Boda, Dezső, He, Yan, Apel, Pavel, Siwy, Zuzanna S.

Journal:

Biophysical Journal

Year:

2008

Language:

english

File:

PDF, 318 KB

english, 2008

4

Monte Carlo Simulation of Free Energy Components: Energetics of Selective Binding in a Reduced Model of L-Type Ca Channels

Giri, Janhavi, Eisenberg, Bob, Gillespie, Dirk, Henderson, Douglas, Boda, Dezső

Journal:

Biophysical Journal

Year:

2010

Language:

english

File:

PDF, 80 KB

english, 2010

5

Heat capacities of the dipolar Yukawa model polar fluid

Máté, Zoltán, Szalai, István, Boda, Dezső, Henderson, Douglas

Journal:

Molecular Physics

Year:

2011

Language:

english

File:

PDF, 311 KB

english, 2011

6

The extrapolation of the vapour—liquid equilibrium curves of pure fluids in the isothermal Gibbs ensemble

BODA, DEZSŐ, KRISTÓF, TAMÁS, LISZI, JÁNOS, SZALAI, ISTVÁN

Journal:

Molecular Physics

Year:

2002

Language:

english

File:

PDF, 1.06 MB

english, 2002

7

The mean spherical approximation for a dipolar Yukawa fluid

Henderson, Douglas, Boda, Dezső, Szalai, István, Chan, Kwong-Yu

Journal:

The Journal of Chemical Physics

Year:

1999

Language:

english

File:

PDF, 374 KB

english, 1999

8

Comment on "The Role of Concentration Dependent Static Permittivity of Electrolyte Solutions in the Debye-Hückel Theory''

Valiskó, Mónika, Boda, Dezső

Journal:

Journal of Physical Chemistry B

Year:

2015

Language:

english

File:

PDF, 171 KB

english, 2015

9

On the low temperature anomalies in the properties of the electrochemical interface. A non-local free-energy density functional approach

MIER-Y-TERAN, LUIS, BODA, DEZSŐ, HENDERSON, DOUGLAS, QUIÑONES-CISNEROS, SERGIO E.

Journal:

Molecular Physics

Year:

2001

Language:

english

File:

PDF, 698 KB

english, 2001

10

Density Functional Theory and the Capillary Evaporation of a Liquid in a Slit

Szabolcs Varga, Dezso&amp, #x030B, Boda, Douglas Henderson, Stefan Sokołowski

Journal:

Journal of Colloid and Interface Science

Year:

2000

Language:

english

File:

PDF, 67 KB

english, 2000

11

Density Functional Study of a Simple Membrane Using the Solvent Primitive Model

Dezso&amp, #x030B, Boda, Douglas Henderson, Andrzej Patrykiejew, Stefan Sokołowski

Journal:

Journal of Colloid and Interface Science

Year:

2001

Language:

english

File:

PDF, 107 KB

english, 2001

12

An extension of the NpT plus test particle method for the determination of the vapour-liquid equilibria of pure fluids

Dezső Boda, János Liszi, István Szalai

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 369 KB

english, 1995

13

A new simulation method for the determination of the vapour-liquid equilibria in the grand canonical ensemble

Dezsó Boda, János Liszi, István Szalai

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 582 KB

english, 1996

14

The capacitance of the electrical double layer of valence-asymmetric salts at low reduced temperatures

Mónika Valiskó, Douglas Henderson, Dezső Boda

Journal:

Journal of Molecular Liquids

Year:

2007

Language:

english

File:

PDF, 240 KB

english, 2007

15

On a conjecture of Fawcett

Douglas Henderson, Dezső Boda

Journal:

Journal of Electroanalytical Chemistry

Year:

2005

Language:

english

File:

PDF, 145 KB

english, 2005

16

A corrected 3D Ewald calculation of the low effective temperature properties of the electrochemical interface

Paul S. Crozier, Richard L. Rowley, Douglas Henderson, Dezsö Boda

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 73 KB

english, 2000

17

A generalized mean spherical approximation of the anomalies in the electrochemical double layer for strong ionic interactions

Douglas Henderson, Dezső Boda, Darsh T Wasan

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 204 KB

english, 2000

18

Low temperature anomalies in the properties of the electrochemical interface

Dezső Boda, Douglas Henderson, Kwong-Yu Chan, Darsh T Wasan

Journal:

Chemical Physics Letters

Year:

1999

Language:

english

File:

PDF, 144 KB

english, 1999

19

Simulation of the selectivity of a calcium channel

Dezso Boda, David D Busath, Douglas Henderson

Journal:

Applied Surface Science

Year:

2002

Language:

english

File:

PDF, 79 KB

english, 2002

20

The isochoric-, isobaric- and saturation-heat capacities of the Lennard-Jones fluid from equations of state and Monte Carlo simulations

Dezsö Boda, Tamás Lukács, János Liszi, István Szalai

Journal:

Fluid Phase Equilibria

Year:

1996

Language:

english

File:

PDF, 823 KB

english, 1996

21

On the influence of ionic association on the capacitance of an electrical double layer

Myroslav Holovko, Vitalyj Kapko, Douglas Henderson, Dezsö Boda

Journal:

Chemical Physics Letters

Year:

2001

Language:

english

File:

PDF, 135 KB

english, 2001

22

Computer Simulation Studies of the Selectivity and Conductance of A Model Calcium Channel

Yan Yang, Dezsö Boda, Douglas Henderson, David Busath

Journal:

Journal of Computational Electronics

Year:

2002

Language:

english

File:

PDF, 60 KB

english, 2002

23

Protein structure and ionic selectivity in calcium channels: Selectivity filter size, not shape, matters

Attila Malasics, Dirk Gillespie, Wolfgang Nonner, Douglas Henderson, Bob Eisenberg, Dezső Boda

Journal:

Biochimica et Biophysica Acta (BBA) - Biomembranes

Year:

2009

Language:

english

File:

PDF, 1.91 MB

english, 2009

24

Current and selectivity in a model sodium channel under physiological conditions: Dynamic Monte Carlo simulations

Éva Csányi, Dezső Boda, Dirk Gillespie, Tamás Kristóf

Journal:

Biochimica et Biophysica Acta (BBA) - Biomembranes

Year:

2012

Language:

english

File:

PDF, 1.63 MB

english, 2012

25

Simulation of an Electrical Double Layer Model with a Low Dielectric Layer between the Electrode and the Electrolyte

Nagy, Tímea, Henderson, Douglas, Boda, Dezső

Journal:

Journal of Physical Chemistry B

Year:

2011

Language:

english

File:

PDF, 4.93 MB

english, 2011

26

Ions and Inhibitors in the Binding Site of HIV Protease: Comparison of Monte Carlo Simulations and the Linearized Poisson-Boltzmann Theory

Boda, Dezső, Valiskó, Mónika, Henderson, Douglas, Gillespie, Dirk, Eisenberg, Bob, Gilson, Michael K.

Journal:

Biophysical Journal

Year:

2009

Language:

english

File:

PDF, 1.26 MB

english, 2009

27

Conductance and Concentration Relationship in a Reduced Model of the K Channel

Fonseca, James E., Boda, Dezso, Nonner, Wolfgang, Eisenberg, Bob

Journal:

Biophysical Journal

Year:

2010

Language:

english

File:

PDF, 36 KB

english, 2010

28

Brownian Dynamics Simulation of Calcium Channels

Berti, Claudio, Furini, Simone, Gillespie, Dirk, Boda, Dezsö, Eisenberg, Bob, Fiegna, Claudio

Journal:

Biophysical Journal

Year:

2012

Language:

english

File:

PDF, 32 KB

english, 2012

29

Steric Selectivity in Na Channels Arising from Protein Polarization and Mobile Side Chains

Boda, Dezső, Nonner, Wolfgang, Valiskó, Mónika, Henderson, Douglas, Eisenberg, Bob, Gillespie, Dirk

Journal:

Biophysical Journal

Year:

2007

Language:

english

File:

PDF, 874 KB

english, 2007

30

Volume Exclusion in Calcium Selective Channels

Boda, Dezső, , Nonner, Wolfgang, Henderson, Douglas, Eisenberg, Bob, Gillespie, Dirk

Journal:

Biophysical Journal

Year:

2008

Language:

english

File:

PDF, 1.79 MB

english, 2008

31

The Anomalous Mole Fraction Effect in Calcium Channels: A Measure of Preferential Selectivity

Gillespie, Dirk, Boda, Dezsö

Journal:

Biophysical Journal

Year:

2008

Language:

english

File:

PDF, 308 KB

english, 2008

32

Correction to the Clausius–Mosotti equation: The dielectric constant of nonpolar fluids from Monte Carlo simulations

Valiskó, Mónika, Boda, Dezső

Journal:

The Journal of Chemical Physics

Year:

2009

Language:

english

File:

PDF, 405 KB

english, 2009

33

Monte Carlo simulation of the electric double layer: dielectric boundaries and the effects of induced charge

Henderson *, Douglas, Gillespie, Dirk, Nagy, TÍmea, Boda, Dezsö

Journal:

Molecular Physics

Year:

2005

Language:

english

File:

PDF, 276 KB

english, 2005

34

Tuning Transport Properties of Nanofluidic Devices with Local Charge Inversion

He, Yan, Gillespie, Dirk, Boda, Dezsö, Vlassiouk, Ivan, Eisenberg, Robert S., Siwy, Zuzanna S.

Journal:

Journal of the American Chemical Society

Year:

2009

Language:

english

File:

PDF, 1.01 MB

english, 2009

35

Relating Binding Affinity to Dynamical Selectivity from Dynamic Monte Carlo Simulations of a Model Calcium Channel

Rutkai, Gábor, Boda, Dezső, Kristóf, Tamás

Journal:

The Journal of Physical Chemistry Letters

Year:

2010

Language:

english

File:

PDF, 1.77 MB

english, 2010

36

Phase separation in mixtures of Yukawa and charged Yukawa particles from Gibbs ensemble Monte Carlo simulations and the mean spherical approximation

Kristóf, Tamás, Boda, Dezsö, Henderson, Douglas

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 212 KB

english, 2004

37

Simulating prescribed particle densities in the grand canonical ensemble using iterative algorithms

Malasics, Attila, Gillespie, Dirk, Boda, Dezső

Journal:

The Journal of Chemical Physics

Year:

2008

Language:

english

File:

PDF, 568 KB

english, 2008

38

Selective transport through a model calcium channel studied by Local Equilibrium Monte Carlo simulations coupled to the Nernst–Planck equation

Boda, Dezső, Kovács, Róbert, Gillespie, Dirk, Kristóf, Tamás

Journal:

Journal of Molecular Liquids

Year:

2014

Language:

english

File:

PDF, 876 KB

english, 2014

39

Monte Carlo, density functional theory, and Poisson–Boltzmann theory study of the structure of an electrolyte near an electrode

Boda, Dezsö, Fawcett, W. Ronald, Henderson, Douglas, Sokołowski, Stefan

Journal:

The Journal of Chemical Physics

Year:

2002

Language:

english

File:

PDF, 291 KB

english, 2002

40

Self-organized Models of Selectivity in Ca and Na Channels

Eisenberg, Bob, Boda, Dezso, Giri, Janhavi, Fonseca, James, Gillespie, Dirk, Henderson, Douglas, Nonner, Wolfgang

Journal:

Biophysical Journal

Year:

2009

Language:

english

File:

PDF, 41 KB

english, 2009

41

Current and Selectivity in a Model Sodium Channel under Physiological Conditions

Gillespie, Dirk, Boda, Dezso, Kristof, Tamas

Journal:

Biophysical Journal

Year:

2012

Language:

english

File:

PDF, 42 KB

english, 2012

42

Brownian Dynamics Study of Current and Selectivity of Calcium Channels

Berti, Claudio, Gillespie, Dirk, Boda, Dezsö, Eisenberg, Bob, Fiegna, Claudio

Journal:

Biophysical Journal

Year:

2013

Language:

english

File:

PDF, 83 KB

english, 2013

43

Relative Permittivity of Polar Liquids. Comparison of Theory, Experiment, and Simulation

Valiskó, Mónika, Boda, Dezső

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 304 KB

english, 2005

44

Anomalous temperature dependence of the differential capacitance in valence asymmetric electrolytes. Comparison of Monte Carlo simulation results and the field theoretical approach

Di Caprio, Dung, Valiskó, Mónika, Holovko, Myroslav, Boda, Dezső

Journal:

Molecular Physics

Year:

2006

Language:

english

File:

PDF, 272 KB

english, 2006

45

Three-Dimensional Brownian Dynamics Simulator for the Study of Ion Permeation through Membrane Pores

Berti, Claudio, Furini, Simone, Gillespie, Dirk, Boda, Dezső, Eisenberg, Robert S., Sangiorgi, Enrico, Fiegna, Claudio

Journal:

Journal of Chemical Theory and Computation

Year:

2014

Language:

english

File:

PDF, 3.40 MB

english, 2014

46

Monte Carlo Study of the Effect of Ion and Channel Size on the Selectivity of a Model Calcium Channel †

Boda, Dezsö, Henderson, Douglas, Busath, David D.

Journal:

Journal of Physical Chemistry B

Year:

2001

Language:

english

File:

PDF, 58 KB

english, 2001

47

Steady-State Electrodiffusion from the Nernst–Planck Equation Coupled to Local Equilibrium Monte Carlo Simulations

Boda, Dezső, Gillespie, Dirk

Journal:

Journal of Chemical Theory and Computation

Year:

2012

Language:

english

File:

PDF, 1.04 MB

english, 2012

48

Behavior of 2:1 and 3:1 Electrolytes at Polarizable Interfaces

Nagy, Tímea, Valiskó, Mónika, Henderson, Douglas, Boda, Dezső

Journal:

Journal of Chemical & Engineering Data

Year:

2011

Language:

english

File:

PDF, 1.32 MB

english, 2011

49

Structure and Pressure of a Hard Sphere Fluid in a Wedge-Shaped Cell or Meniscus

Boda, Dezsö, Chan, Kwong-Yu, Henderson, Douglas, Wasan, Darsh T., Nikolov, Alex D.

Journal:

Year:

1999

Language:

english

File:

PDF, 83 KB

english, 1999

50

The nonmonotonic concentration dependence of the mean activity coefficient of electrolytes is a result of a balance between solvation and ion-ion correlations

Vincze, Julianna, Valiskó, Mónika, Boda, Dezső

Journal:

The Journal of Chemical Physics

Year:

2010

Language:

english

File:

PDF, 326 KB

english, 2010

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