42 citations · 107 across the 7 of their papers we have counts for
5 papers · 1 filter
Affinity, Kinetics, and Pathways of Anisotropic Ligands Binding to Hydrophobic Model Pockets
R. Gregor Weiß, Richard Chudoba, Piotr Setny +1
Using explicit-water molecular dynamics (MD) simulations of a generic pocket-ligand model we investigate how chemical and shape anisotropy of small ligands influences the affinitie…
Tuning the Selective Permeability of Polydisperse Polymer Networks
Won Kyu Kim, Richard Chudoba, Sebastian Milster +3
We study the permeability and selectivity (`permselectivity') of model membranes made of polydisperse polymer networks for molecular penetrant transport, using coarse-grained, impl…
Cross-linker effect on solute adsorption in swollen thermoresponsive polymer networks
Sebastian Milster, Richard Chudoba, Matej Kanduč +1
The selective solute partitioning within a polymeric network is of key importance to applications in which controlled release or uptake of solutes in a responsive hydrogel is requi…
Selective solute adsorption and partitioning around single PNIPAM chains
Matej Kanduc, Richard Chudoba, Karol Palczynski +3
Thermoresponsive polymer architectures have become integral building blocks of 'smart' functional materials in modern applications. For a large range of developments, e.g., for dru…
Tuning the critical solution temperature of polymers by copolymerization
Bernhard Schulz, Richard Chudoba, Jan Heyda +1
We study statistical copolymerization effects on the upper critical solution temperature (CST) of generic homopolymers by means of coarse-grained Langevin dynamics computer simulat…