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Journal Articles by P. Košovan

S. P. Pineda, P. M. Blanco, R. Staňo, and P. Košovan,
Patchy Charge Distribution Affects the pH in Protein Solutions during Dialysis

Langmuir, 41(8), 2025

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D. Beyer, P. M. Blanco, J. Landsgesell, P. Košovan, and C. Holm,
How To Correct Erroneous Symmetry-Breaking in Coarse-Grained Constant-pH Simulations

Journal of Chemical Theory and Computation, 21(3), 2025

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P. M. Blanco, and P. Košovan,
The explicit bonding reaction ensemble Monte Carlo method

The Journal of Chemical Physics, 161(9), 2024

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D. Beyer, P. B. Torres, S. P. Pineda, C. F. Narambuena, J.-N. Grad, P. Košovan, and P. M. Blanco,
pyMBE: The Python-based molecule builder for ESPResSo

The Journal of Chemical Physics, 161(2), 2024

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S. P. Pineda R. Staňo A. Murmiliuk P. M. Blanco P. Montes Z. Tošner O. Groborz J. Pánek et al.
Charge Regulation Triggers Condensation of Short Oligopeptides to Polyelectrolytes

JACS Au, 2024

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R. Staňo, J. J. van Lente, S. Lindhoud, and P. Košovan,
Sequestration of Small Ions and Weak Acids and Bases by a Polyelectrolyte Complex Studied by Simulation and Experiment

Macromolecules, 57(3), 2024

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D. Beyer, J. Landsgesell, P. Hebbeker, O. Rud, R. Lunkad, P. Košovan, and C. Holm,
Correction to “Grand-Reaction Method for Simulations of Ionization Equilibria Coupled to Ion Partitioning”

Macromolecules, 55(3), 2022

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J. Landsgesell, D. Beyer, P. Hebbeker, P. Košovan, and C. Holm,
The pH-Dependent Swelling of Weak Polyelectrolyte Hydrogels Modeled at Different Levels of Resolution

Macromolecules, 55(8), 2022

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A. Murmiliuk S. K. Filippov O. Rud P. Košovan Z. Tošner A. Radulescu A. Skandalis S. Pispas et al.
Reversible multilayered vesicle-like structures with fluid hydrophobic and interpolyelectrolyte layers
Elsevier BV, 2021

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Journal of Colloid and Interface Science, 599, 2021

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O. V. Rud, J. Landsgesell, C. Holm, and P. Košovan,
Modeling of weak polyelectrolyte hydrogels under compression - Implications for water desalination

Desalination, 506, 2021

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R. Staňo, P. Košovan, A. Tagliabue, and C. Holm,
Electrostatically Cross-Linked Reversible Gels—Effects of pH and Ionic Strength

Macromolecules, 54, 2021

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R. Lunkad, A. Murmiliuk, Z. Tošner, M. Štěpánek, and P. Košovan,
Role of pKA in Charge Regulation and Conformation of Various Peptide Sequences

Polymers, 13(2), 214, 2021

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A. D. Kazakov, V. M. Prokacheva, F. Uhlík, P. Košovan, and F. A. M. Leermakers,
Computer modeling of polymer stars in variable solvent conditions: a comparison of MD simulations, self-consistent field (SCF) modeling and novel hybrid Monte Carlo SCF approach
Royal Society of Chemistry (RSC), 2021

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R. Lunkad, A. Murmiliuk, P. Hebbeker, M. Boublík, Z. Tošner, M. Štěpánek, and P. Košovan,
Quantitative prediction of charge regulation in oligopeptides
Royal Society of Chemistry (RSC), 2021

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R. Lunkad, A. Murmiliuk, P. Hebbeker, M. Boublík, Z. Tošner, M. Štěpánek, and P. Košovan,
Quantitative prediction of charge regulation in oligopeptides

Molecular Systems Design & Engineering, 6, 122-131, 2020

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R. Lunkad, A. Murmiliuk, P. Hebbeker, M. Boublík, Z. Tošner, M. Štěpánek, and P. Košovan,
Quantitative prediction of charge regulation in oligopeptides

Molecular Systems Design & Engineering, 6, 2020

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Soft Matter, 17, 580-591, 2020

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J. Landsgesell, P. Hebbeker, O. Rud, R. Lunkad, P. Košovan, and C. Holm,
Grand-Reaction Method for Simulations of Ionization Equilibria Coupled to Ion Partitioning

Macromolecules, 53(8), 2020

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R. Staňo, L. Nová, F. Uhlík, and P. Košovan,
Multivalent counterions accumulate in star-like polyelectrolytes and collapse the polymer in spite of increasing its ionization
Royal Society of Chemistry (RSC), 2020

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R. Fernandez-Alvarez, L. Nová, F. Uhlík, S. Kereïche, M. Uchman, P. Košovan, and P. Matějíček,
Interactions of star-like polyelectrolyte micelles with hydrophobic counterions

Journal of Colloid and Interface Science, 546, 2019

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J. Landsgesell, L. Nová, O. Rud, F. Uhlík, D. Sean, P. Hebbeker, C. Holm, and P. Košovan,
Simulations of ionization equilibria in weak polyelectrolyte solutions and gels

Soft Matter, 15(6), 2019

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J. Landsgesell, L. Nová, O. Rud, F. Uhlík, D. Sean, P. Hebbeker, C. Holm, and P. Košovan,
Simulations of ionization equilibria in weak polyelectrolyte solutions and gels

Soft Matter, 15(6), 2019

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J. Landsgesell, L. Nová, O. Rud, F. Uhlík, D. Sean, P. Hebbeker, C. Holm, and P. Košovan,
Simulations of ionization equilibria in weak polyelectrolyte solutions and gels

Soft Matter, 15(6), 2019

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A. Murmiliuk, P. Košovan, M. Janata, K. Procházka, F. Uhlík, and M. Štěpánek,
Local pH and Effective pK of a Polyelectrolyte Chain: Two Names for One Quantity?

ACS Macro Letters, 7(10), 2018

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T. Richter, J. Landsgesell, P. Košovan, and C. Holm,
On the efficiency of a hydrogel-based desalination cycle

Desalination, 414, 2017

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O. Rud, T. Richter, O. Borisov, C. Holm, and P. Košovan,
A self-consistent mean-field model for polyelectrolyte gels

Soft Matter, 13(18), 2017

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L. Nová, F. Uhlík, and P. Košovan,
Local pH and effective pK A of weak polyelectrolytes – insights from computer simulations

Physical Chemistry Chemical Physics, 19(22), 2017

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L. Nová, F. Uhlík, and P. Košovan,
Local pH and effective pK A of weak polyelectrolytes – insights from computer simulations

Physical Chemistry Chemical Physics, 19(22), 2017

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O. Rud, T. Richter, O. Borisov, C. Holm, and P. Košovan,
A self-consistent mean-field model for polyelectrolyte gels

Soft Matter, 13(18), 2017

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P. Košovan, T. Richter, and C. Holm,
Modeling of Polyelectrolyte Gels in Equilibrium with Salt Solutions

Macromolecules, 48(20), 2015

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F. Uhlík, P. Košovan, Z. Limpouchová, K. Procházka, O. V. Borisov, and F. A. M. Leermakers,
Modeling of Ionization and Conformations of Starlike Weak Polyelectrolytes

Macromolecules, 47(12), 2014

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J. Kuldová, P. Košovan, Z. Limpouchová, and K. Procházka,
Computer Study of the Association Behavior of Gradient Copolymers: Analysis of Simulation Results Based on a New Algorithm for Recognition and Classification of Aggregates

Macromolecular Theory and Simulations, 22(1), 2012

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Z. Preisler, P. Košovan, J. Kuldová, F. Uhlík, Z. Limpouchová, K. Procházka, and F. A. M. Leermakers,
Depletion profiles for dilute solutions of linear chains, stars and H-branched molecules by self-consistent field calculations and Monte Carlo simulations

Soft Matter, 7(21), 2011

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Book Chapters

R. Weeber J.-N. Grad D. Beyer P. M. Blanco P. Kreissl A. Reinauer I. Tischler P. Košovan et al.
ESPResSo, a Versatile Open-Source Software Package for Simulating Soft Matter Systems
Comprehensive Computational Chemistry, Elsevier, 2024, ISBN 9780128232569

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