Programming configurational changes in systems of functionalised polymers using reversible intramolecular linkages

Efficient sampling of reversible cross-linking polymers: Self-assembly of single-chain polymeric nanoparticles

(2018) Bernardo Oyarzún et al.   JOURNAL OF CHEMICAL PHYSICS

Coherent states field theory in supramolecular polymer physics

(2018) Glenn H. Fredrickson et al.   JOURNAL OF CHEMICAL PHYSICS

Using DNA strand displacement to control interactions in DNA-grafted colloids

(2018) Emily W. Gehrels et al.   Soft Matter

Three-body potential for simulating bond swaps in molecular dynamics

(2017) Francesco Sciortino   EUROPEAN PHYSICAL JOURNAL E

A multi-chain polymer slip-spring model with fluctuating number of entanglements: Density fluctuations, confinement, and phase separation

(2017) Abelardo Ramírez-Hernández et al.   JOURNAL OF CHEMICAL PHYSICS

Improving the Efficiency of Configurational-Bias Monte Carlo: Extension of the Jacobian–Gaussian Scheme to Interior Sections of Cyclic and Polymeric Molecules

(2017) Aliasghar Sepehri et al.   Journal of Chemical Theory and Computation

Improving the Folding of Supramolecular Copolymers by Controlling the Assembly Pathway Complexity

(2017) Gijs M. ter Huurne et al.   MACROMOLECULES

Monte Carlo sampling for stochastic weight functions

(2017) Daan Frenkel et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Controlling Self-Assembly Kinetics of DNA-Functionalized Liposomes Using Toehold Exchange Mechanism

(2016) Lucia Parolini et al.   ACS Nano

Concentrated Solutions of Single-Chain Nanoparticles: A Simple Model for Intrinsically Disordered Proteins under Crowding Conditions

(2016) Angel J. Moreno et al.   Journal of Physical Chemistry Letters

Liquid-crystal phase equilibria of Lennard-Jones chains

(2016) Bernardo Oyarzún Rivera et al.   MOLECULAR PHYSICS

Formation of Chromosomal Domains by Loop Extrusion

(2016) Geoffrey Fudenberg et al.   Cell Reports

Simulating the Reactions of CO2 in Aqueous Monoethanolamine Solution by Reaction Ensemble Monte Carlo Using the Continuous Fractional Component Method

(2015) Sayee Prasaad Balaji et al.   Journal of Chemical Theory and Computation

Single-Chain Folding of Synthetic Polymers: A Critical Update

(2015) Ozcan Altintas et al.   MACROMOLECULAR RAPID COMMUNICATIONS

Simulation guided design of globular single-chain nanoparticles by tuning the solvent quality

(2015) Federica Lo Verso et al.   Soft Matter

A new configurational bias scheme for sampling supramolecular structures

(2014) Robin De Gernier et al.   JOURNAL OF CHEMICAL PHYSICS

A Comparison of Advanced Monte Carlo Methods for Open Systems: CFCMC vs CBMC

(2014) Ariana Torres-Knoop et al.   Journal of Chemical Theory and Computation

Effect of Inert Tails on the Thermodynamics of DNA Hybridization

(2014) Lorenzo Di Michele et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Folding Polymers with Pendant Hydrogen Bonding Motifs in Water: The Effect of Polymer Length and Concentration on the Shape and Size of Single-Chain Polymeric Nanoparticles

(2014) Patrick J. M. Stals et al.   MACROMOLECULES

Modeling epigenome folding: formation and dynamics of topologically associated chromatin domains

(2014) Daniel Jost et al.   NUCLEIC ACIDS RESEARCH

Multi-orthogonal folding of single polymer chains into soft nanoparticles

(2014) Federica Lo Verso et al.   Soft Matter

Sequence Controlled Self-Knotting Colloidal Patchy Polymers

(2013) Ivan Coluzza et al.   PHYSICAL REVIEW LETTERS

Self-Consistent Field Approach for Cross-Linked Copolymer Materials

(2013) Friederike Schmid   PHYSICAL REVIEW LETTERS

Phase behavior and critical activated dynamics of limited-valence DNA nanostars

(2013) S. Biffi et al.   PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA

Single chain polymeric nanoparticles as compartmentalised sensors for metal ions

(2012) Martijn A. J. Gillissen et al.   Polymer Chemistry

Functional Supramolecular Polymers

(2012) T. Aida et al.   SCIENCE

Reaction Ensemble Monte Carlo Simulation of Complex Molecular Systems

(2011) Thomas W. Rosch et al.   Journal of Chemical Theory and Computation

Silica-Like Malleable Materials from Permanent Organic Networks

(2011) D. Montarnal et al.   SCIENCE

Field-theoretic model of inhomogeneous supramolecular polymer networks and gels

(2010) Aruna Mohan et al.   JOURNAL OF CHEMICAL PHYSICS

Emerging applications of stimuli-responsive polymer materials

(2010) Martien A. Cohen Stuart et al.   NATURE MATERIALS

Accurate Estimate of the Critical Exponentνfor Self-Avoiding Walks via a Fast Implementation of the Pivot Algorithm

(2010) Nathan Clisby   PHYSICAL REVIEW LETTERS

Control of DNA Strand Displacement Kinetics Using Toehold Exchange

(2009) David Yu Zhang et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Simulation of chemical reaction equilibria by the reaction ensemble Monte Carlo method: a review†

(2008) C. Heath Turner et al.   MOLECULAR SIMULATION