Critical test of bead–spring model to resolve the scaling laws of polymer melts: a molecular dynamics study

Molecular Dynamics Simulations for Resolving Scaling Laws of Polyethylene Melts

(2017) Kazuaki Takahashi et al.   Polymers

Structural origin of slow diffusion in protein folding

(2015) H. S. Chung et al.   SCIENCE

Healing of polymer interfaces: Interfacial dynamics, entanglements, and strength

(2014) Ting Ge et al.   PHYSICAL REVIEW E

Molecular Scale Dynamics of Large Ring Polymers

(2014) S. Gooßen et al.   PHYSICAL REVIEW LETTERS

Role of block copolymer morphology on particle percolation of polymer nanocomposites

(2014) Yancong Feng et al.   Soft Matter

Simulating the Flow of Entangled Polymers

(2014) Yuichi Masubuchi   Annual Review of Chemical and Biomolecular Engineering

Polymer collapse in miscible good solvents is a generic phenomenon driven by preferential adsorption

(2014) Debashish Mukherji et al.   Nature Communications

Coarse-grain modelling of protein–protein interactions

(2013) Marc Baaden et al.   CURRENT OPINION IN STRUCTURAL BIOLOGY

Self-Healing of Unentangled Polymer Networks with Reversible Bonds

(2013) Evgeny B. Stukalin et al.   MACROMOLECULES

Thermodynamics of Writhe in DNA Minicircles from Molecular Dynamics Simulations

(2013) Jonathan S. Mitchell et al.   PHYSICAL REVIEW LETTERS

Li+Transport in Poly(Ethylene Oxide) Based Electrolytes: Neutron Scattering, Dielectric Spectroscopy, and Molecular Dynamics Simulations

(2013) Changwoo Do et al.   PHYSICAL REVIEW LETTERS

Complex Tracer Diffusion Dynamics in Polymer Solutions

(2013) Apostolos Vagias et al.   PHYSICAL REVIEW LETTERS

Molecular Dynamics Simulations of Polymer Welding: Strength from Interfacial Entanglements

(2013) Ting Ge et al.   PHYSICAL REVIEW LETTERS

Nonspecific bridging-induced attraction drives clustering of DNA-binding proteins and genome organization

(2013) C. A. Brackley et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

How Good Are Coarse-Grained Polymer Models? A Comparison for Atactic Polystyrene

(2012) Hossein Ali Karimi-Varzaneh et al.   CHEMPHYSCHEM

Polymer brushes on flat and curved surfaces: How computer simulations can help to test theories and to interpret experiments

(2012) K. Binder et al.   JOURNAL OF POLYMER SCIENCE PART B-POLYMER PHYSICS

On developing coarse-grained models for biomolecular simulation: a review

(2012) Sereina Riniker et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Systematic coarse-graining methods for soft matter simulations – a review

(2012) Emiliano Brini et al.   Soft Matter

Chain Dynamics of Ring and Linear Polyethylene Melts from Molecular Dynamics Simulations

(2011) Kahyun Hur et al.   MACROMOLECULES

Interface of Grafted and Ungrafted Silica Nanoparticles with a Polystyrene Matrix: Atomistic Molecular Dynamics Simulations

(2011) Tinashe V. M. Ndoro et al.   MACROMOLECULES

Polymer brushes under flow and in other out-of-equilibrium conditions

(2011) Kurt Binder et al.   Soft Matter

Quantifying chain reptation in entangled polymer melts: Topological and dynamical mapping of atomistic simulation results onto the tube model

(2010) Pavlos S. Stephanou et al.   JOURNAL OF CHEMICAL PHYSICS

Frictional Forces between Strongly Compressed, Nonentangled Polymer Brushes: Molecular Dynamics Simulations and Scaling Theory

(2010) A. Galuschko et al.   LANGMUIR

Flow Effects on Melt Structure and Entanglement Network of Linear Polymers: Results from a Nonequilibrium Molecular Dynamics Simulation Study of a Polyethylene Melt in Steady Shear

(2010) Chunggi Baig et al.   MACROMOLECULES

Molecular Theory of Weak Polyelectrolyte Gels: The Role of pH and Salt Concentration

(2010) Gabriel S. Longo et al.   MACROMOLECULES

Novel percolation phenomena and mechanism of strengthening elastomers by nanofillers

(2010) Zhenhua Wang et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Molecular dynamics simulations of deformation mechanisms of amorphous polyethylene

(2010) D. Hossain et al.   POLYMER

Molecular dynamics simulations of glassy polymers

(2010) Jean-Louis Barrat et al.   Soft Matter

Dynamics of Polystyrene Melts through Hierarchical Multiscale Simulations

(2009) Vagelis A. Harmandaris et al.   MACROMOLECULES

Topological analysis of polymeric melts: Chain-length effects and fast-converging estimators for entanglement length

(2009) Robert S. Hoy et al.   PHYSICAL REVIEW E