38 citations · 300 across the 22 of their papers we have counts for
5 papers · 1 filter
Multiscale modeling of a rectifying bipolar nanopore: explicit-water versus implicit-water simulations
Zoltán Ható, Mónika Valiskó, Tamás Kristóf +2
In a multiscale modeling approach, we present computer simulation results for a rectifying bipolar nanopore on two modeling levels. In an all-atom model, we use explicit water to s…
Simulation of a model nanopore sensor: ion competition underlies device behavior
Eszter Mádai, Mónika Valiskó, András Dallos +1
We study a model nanopore sensor with which a very low concentration of analyte molecules can be detected on the basis of the selective binding of the analyte molecules to the bind…
A systematic Monte Carlo simulation study of the primitive model electrical double layer over an extended range of concentrations, electrode charges, cation diameters and valences
Mónika Valiskó, Tamás Kristóf, Dirk Gillespie +1
The purpose of this study is to provide data for the primitive model of the electrical double layer, where ions are modeled as charged hard spheres, the solvent as an implicit diel…
Multiscale modeling of a rectifying bipolar nanopore: Comparing Poisson-Nernst-Planck to Monte Carlo
Bartłomiej Matejczyk, Mónika Valiskó, Marie-Therese Wolfram +2
In the framework of a multiscale modeling approach, we present a systematic study of a bipolar rectifying nanopore using a continuum and a particle simulation method. The common gr…
Activity coefficients of individual ions in LaCl from the II+IW theory
Mónika Valiskó, Dezső Boda
We investigate the individual activity coefficients of ions in LaCl using our theory that is based on the competition of ion-ion (II) and ion-water (IW) interactions (Vincze…