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coarse-grained models
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Multiscale modelling of DNA mechanics
2015 |
Faculty of Science
publication
Fast Leaps between Millisecond Confinements Govern Ase1 Diffusion along Microtubules
2021 |
Faculty of Mathematics and Physics
publication
Lipid molecules can induce an opening of membrane-facing tunnels in cytochrome P450 1A2
2016 |
Faculty of Science
publication
Dissipative particle dynamics simulations of polyelectrolyte self-assemblies. Methods with explicit electrostatics
2017 |
Faculty of Science
publication
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
2021 |
Faculty of Science
publication
The drag of the tails: Diffusion of sticky nanoparticles in dilute polymer solutions
2015 |
Faculty of Science
publication
Quantitative prediction of charge regulation in oligopeptides
2021 |
Faculty of Science
publication
Coassembly of Poly(N-isopropylacrylamide) with Dodecyl and Carboxyl Terminal Groups with Cationic Surfactant: Critical Comparison of Experimental and Simulation Data
2018 |
Faculty of Science
publication
Water Desalination Using Polyelectrolyte Hydrogel: Gibbs Ensemble Modeling
2022 |
Faculty of Science
publication
Coarse-grained simulations of an ionic liquid-based capacitor: I. Density, ion size, and valency effects
2014 |
Faculty of Science
publication
Role of pK(A) in Charge Regulation and Conformation of Various Peptide Sequences
2021 |
Faculty of Science
publication
Salt Counterion Valency Controls the Ionization and Morphology of Weak Polyelectrolyte Miktoarm Stars
2022 |
Faculty of Science