Solute diffusion in gels: Thirty years of simulations

Coarse-grained simulations of diffusion controlled release of drugs from neutral nanogels: Effect of excluded volume interactions

(2020) José Alberto Maroto-Centeno et al.   JOURNAL OF CHEMICAL PHYSICS

A review of coarse-grained simulations of nanogel and microgel particles

(2019) Alberto Martín-Molina et al.   JOURNAL OF MOLECULAR LIQUIDS

Tailoring the Chemical Modification of Chitosan Hydrogels to Fine-Tune the Release of a Synergistic Combination of Chemotherapeutics

(2019) John D. Schneible et al.   BIOMACROMOLECULES

Diffusion coefficient of solute in heterogeneous and macroporous hydrogels and its correlation with the effective crosslinking density

(2019) Hideaki Tokuyama et al.   JOURNAL OF MEMBRANE SCIENCE

Particle Trapping Mechanisms Are Different in Spatially Ordered and Disordered Interacting Gels

(2018) Johann Hansing et al.   BIOPHYSICAL JOURNAL

Estimating the Diffusion Coefficients of Sugars Using Diffusion Experiments in Agar-Gel and Computer Simulations

(2018) Shuichi Miyamoto et al.   CHEMICAL & PHARMACEUTICAL BULLETIN

On the dilemma of fractal or fractional kinetics in drug release studies: A comparison between Weibull and Mittag-Leffler functions

(2018) Kosmas Kosmidis et al.   INTERNATIONAL JOURNAL OF PHARMACEUTICS

Particle Diffusion in Polymeric Hydrogels with Mixed Attractive and Repulsive Interactions

(2018) Johann Hansing et al.   NANO LETTERS

An anionic shell shields a cationic core allowing for uptake and release of polyelectrolytes within core–shell responsive microgels

(2018) Arjan P. H. Gelissen et al.   Soft Matter

Hydrodynamic Effects on Particle Diffusion in Polymeric Hydrogels with Steric and Electrostatic Particle–Gel Interactions

(2018) Johann Hansing et al.   MACROMOLECULES

Enhanced diffusion by binding to the crosslinks of a polymer gel

(2018) Carl P. Goodrich et al.   Nature Communications

Brownian Dynamics Computational Model of Protein Diffusion in Crowded Media with Dextran Macromolecules as Obstacles

(2017) Pablo Blanco et al.   Entropy

Adenosine triphosphate diffusion through poly(ethylene glycol) diacrylate hydrogels can be tuned by cross-link density as measured by PFG-NMR

(2017) Günter Majer et al.   JOURNAL OF CHEMICAL PHYSICS

Analysis and Control of Chain Mobility in Protein Hydrogels

(2017) Peter B. Rapp et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Drug Release from Inert Spherical Matrix Systems Using Monte Carlo Simulations

(2017) Rafael Villalobos et al.   Current Drug Delivery

Nanoparticle filtering in charged hydrogels: Effects of particle size, charge asymmetry and salt concentration

(2016) Johann Hansing et al.   EUROPEAN PHYSICAL JOURNAL E

Predicting the Chemical Potential and Osmotic Pressure of Polysaccharide Solutions by Molecular Simulations

(2016) Jörg Sauter et al.   Journal of Chemical Theory and Computation

Tracer diffusion in a polymer gel: simulations of static and dynamic 3D networks using spherical boundary conditions

(2016) Natasha Kamerlin et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Biocompatible stimuli-responsive nanogels for controlled antitumor drug delivery

(2016) Garbiñe Aguirre et al.   JOURNAL OF POLYMER SCIENCE PART A-POLYMER CHEMISTRY

A review on particle dynamics simulation techniques for colloidal dispersions: Methods and applications

(2016) Jun Dong Park et al.   KOREAN JOURNAL OF CHEMICAL ENGINEERING

Diffusion of macromolecules in a polymer hydrogel: from microscopic to macroscopic scales

(2016) D. Sandrin et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Particle Transport through Hydrogels Is Charge Asymmetric

(2015) Xiaolu Zhang et al.   BIOPHYSICAL JOURNAL

Non-universal tracer diffusion in crowded media of non-inert obstacles

(2015) Surya K. Ghosh et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Thermo-responsive gels in the presence of monovalent salt at physiological concentrations: A Monte Carlo simulation study

(2014) Manuel Quesada-Pérez et al.   JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS

Excluded volume effects on ionic partitioning in gels and microgels: a simulation study

(2014) Silvia Ahualli et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Anomalous diffusion models and their properties: non-stationarity, non-ergodicity, and ageing at the centenary of single particle tracking

(2014) Ralf Metzler et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Diffusion and interaction in PEG-DA hydrogels

(2013) Valentin Hagel et al.   Biointerphases

Macromolecule Sorption and Diffusion in HEMA/MAA Hydrogels

(2013) D. E. Liu et al.   INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH

Nanoparticle diffusion in, and microrheology of, the bovine vitreous ex vivo

(2013) Qingguo Xu et al.   JOURNAL OF CONTROLLED RELEASE

Brownian Dynamics Simulation of Self-Diffusion of Ionic Large Solute Molecule in Modeled Polyelectrolyte Gel

(2012) Tatsuhiko Miyata   JOURNAL OF THE PHYSICAL SOCIETY OF JAPAN

Modeling of diffusion controlled drug delivery

(2011) Juergen Siepmann et al.   JOURNAL OF CONTROLLED RELEASE

Self-diffusion of biomolecules in solution

(2011) Michio Tokuyama et al.   PHYSICAL REVIEW E

Characterization of Particle Translocation through Mucin Hydrogels

(2010) Oliver Lieleg et al.   BIOPHYSICAL JOURNAL

Diffusion Anisotropy in Collagen Gels and Tumors: The Effect of Fiber Network Orientation

(2010) Triantafyllos Stylianopoulos et al.   BIOPHYSICAL JOURNAL

Diffusion of Particles in the Extracellular Matrix: The Effect of Repulsive Electrostatic Interactions

(2010) Triantafyllos Stylianopoulos et al.   BIOPHYSICAL JOURNAL

Comparison of a hydrogel model to the Poisson–Boltzmann cell model

(2009) Gil C. Claudio et al.   JOURNAL OF CHEMICAL PHYSICS

How proteins squeeze through polymer networks: A Cartesian lattice study

(2009) Annika Wedemeier et al.   JOURNAL OF CHEMICAL PHYSICS

Effect of Cross-Linking on the Diffusion of Water, Ions, and Small Molecules in Hydrogels

(2009) Yanbin Wu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Brownian dynamics simulation of tracer diffusion in a cross-linked network

(2009) Huai Zhou et al.   PHYSICAL REVIEW E

Nanoparticles reveal that human cervicovaginal mucus is riddled with pores larger than viruses

(2009) S. K. Lai et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA