In Silico Tracking of Individual Species Accelerating Progress in Macromolecular Engineering and Design

Multiscale modeling of poly(lactic acid) production: From reaction conditions to rheology of polymer melt

(2018) Alexandr Zubov et al.   CHEMICAL ENGINEERING JOURNAL

A deterministic model for positional gradients in copolymers

(2018) Ivan Kryven et al.   CHEMICAL ENGINEERING SCIENCE

Chemical Composition Fractionation of Olefin Plastomers/Elastomers by Solvent and Thermal Gradient Interaction Chromatography

(2018) Anthony Ndiripo et al.   MACROMOLECULAR RAPID COMMUNICATIONS

Ab-Initio-Based Kinetic Modeling to Understand RAFT Exchange: The Case of 2-Cyano-2-Propyl Dodecyl Trithiocarbonate and Styrene

(2017) Gilles B. Desmet et al.   MACROMOLECULAR RAPID COMMUNICATIONS

Defining the Field of Sequence-Controlled Polymers

(2017) Jean-François Lutz   MACROMOLECULAR RAPID COMMUNICATIONS

2D Sequence-Coded Oligourethane Barcodes for Plastic Materials Labeling

(2017) Denise Karamessini et al.   MACROMOLECULAR RAPID COMMUNICATIONS

A detailed mechanistic study of bulk MADIX of styrene and its chain extension

(2017) Dries J. G. Devlaminck et al.   Polymer Chemistry

A complete understanding of the reaction kinetics for the industrial production process of expandable polystyrene

(2016) Lies De Keer et al.   AICHE JOURNAL

Critically Evaluated Rate Coefficients in Radical Polymerization - 8. Propagation Rate Coefficients for Vinyl Acetate in Bulk

(2016) Christopher Barner-Kowollik et al.   MACROMOLECULAR CHEMISTRY AND PHYSICS

Sequence Analysis for Alternating Copolymers by MALDI-TOF-MS: Importance of Initiator Selectivity for Comonomer Pair

(2016) Kana Nishimori et al.   MACROMOLECULAR RAPID COMMUNICATIONS

State-of-the-Art and Progress in Method of Moments for the Model-Based Reversible-Deactivation Radical Polymerization

(2016) Yin-Ning Zhou et al.   Macromolecular Reaction Engineering

Factors Affecting Grafting Density in Surface-Initiated ATRP: A Simulation Study

(2016) Erlita Mastan et al.   MACROMOLECULAR THEORY AND SIMULATIONS

Model-Based Design To Push the Boundaries of Sequence Control

(2016) Stijn K. Fierens et al.   MACROMOLECULES

An alternative method to estimate the bulk backbiting rate coefficient in acrylate radical polymerization

(2016) Yoshi W. Marien et al.   Polymer Chemistry

The strength of multi-scale modeling to unveil the complexity of radical polymerization

(2016) Dagmar R. D’hooge et al.   PROGRESS IN POLYMER SCIENCE

The limits of precision monomer placement in chain growth polymerization

(2016) Guillaume Gody et al.   Nature Communications

An old kinetic method for a new polymerization mechanism: Toward photochemically mediated ATRP

(2015) Yin-Ning Zhou et al.   AICHE JOURNAL

Watching polymers grow: real time monitoring of polymerizations via an on-line ESI-MS/microreactor coupling

(2015) Joris J. Haven et al.   CHEMICAL COMMUNICATIONS

Continuous poly(2-oxazoline) triblock copolymer synthesis in a microfluidic reactor cascade

(2015) Evelien Baeten et al.   CHEMICAL COMMUNICATIONS

Modeling of the ATRcoP Processes of Methyl Methacrylate and 2-(Trimethylsilyl) Ethyl Methacrylate in Continuous Reactors: From CSTR to PFR

(2015) Wei Wang et al.   Macromolecular Reaction Engineering

When Polymer Reaction Engineers Play Dice: Applications of Monte Carlo Models in PRE

(2015) Amanda L. T. Brandão et al.   Macromolecular Reaction Engineering

Stochastic Modeling of Polymer Microstructure From Residence Time Distribution

(2015) Tiago Lemos et al.   Macromolecular Reaction Engineering

The Long and the Short of Radical Polymerization

(2015) Pieter Derboven et al.   MACROMOLECULES

Model-Based Visualization and Understanding of Monomer Sequence Formation in Gradient Copoly(2-oxazoline)s On the basis of 2-Methyl-2-oxazoline and 2-Phenyl-2-oxazoline

(2015) Paul H. M. Van Steenberge et al.   MACROMOLECULES

Model-based design of the polymer microstructure: bridging the gap between polymer chemistry and engineering

(2015) Dagmar R. D'hooge et al.   Polymer Chemistry

Improved kinetic Monte Carlo simulation of chemical composition-chain length distributions in polymerization processes

(2014) P.H.M. Van Steenberge et al.   CHEMICAL ENGINEERING SCIENCE

Deterministic Modeling of Copolymer Microstructure: Composition Drift and Sequence Patterns

(2014) Ivan Kryven et al.   Macromolecular Reaction Engineering

A Detailed Model on Kinetics and Microstructure Evolution during Copolymerization of Ethylene and 1-Octene: From Coordinative Chain Transfer to Chain Shuttling Polymerization

(2014) Yousef Mohammadi et al.   MACROMOLECULES

First principles modelling of free-radical polymerisation kinetics

(2013) Benjamin B. Noble et al.   INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY

The Crucial Role of Diffusional Limitations in Controlled Radical Polymerization

(2013) Dagmar R. D'hooge et al.   Macromolecular Reaction Engineering

Recent developments in the detailed characterization of polymers by multidimensional chromatography

(2012) Anja Baumgaertel et al.   JOURNAL OF CHROMATOGRAPHY A

Synthesis of gradient copolymers with simultaneously tailor-made chain composition distribution and glass transition temperature by semibatch ATRP: From modeling to application

(2012) Yin-Ning Zhou et al.   JOURNAL OF POLYMER SCIENCE PART A-POLYMER CHEMISTRY

Copolymer Composition Determined by LC-MALDI-TOF MS Coupling and “MassChrom2D” Data Analysis

(2012) Steffen M. Weidner et al.   MACROMOLECULAR CHEMISTRY AND PHYSICS

Linear Gradient Quality of ATRP Copolymers

(2012) Paul H. M. Van Steenberge et al.   MACROMOLECULES

Architectural Dispersity in Model Branched Polymers: Analysis and Rheological Consequences

(2011) Frank Snijkers et al.   MACROMOLECULES

Kinetic Monte Carlo Modeling of the Sulfinyl Precursor Route for Poly(p-phenylene vinylene) Synthesis

(2011) Paul H. M. Van Steenberge et al.   MACROMOLECULES

Nitroxide-Mediated Copolymerization of MMA with Styrene: Sequence Analysis of Oligomers by Using Mass Spectrometry

(2011) Inga C. Wienhöfer et al.   MACROMOLECULES

Characterization of polyolefins by comprehensive high-temperature two-dimensional liquid chromatography (HT 2D-LC)

(2010) Anton Ginzburg et al.   EUROPEAN POLYMER JOURNAL

Solvent Effects on Free Radical Polymerization Reactions: The Influence of Water on the Propagation Rate of Acrylamide and Methacrylamide

(2010) Bart De Sterck et al.   MACROMOLECULES

Kinetics of Segment Formation in Nitroxide-Mediated Controlled Radical Polymerization: Comparison with Classic Theory

(2010) Lin Wang et al.   MACROMOLECULES

Mass spectrometry in polymer chemistry: a state-of-the-art up-date

(2010) Till Gruendling et al.   Polymer Chemistry

Chain-length-dependent termination in radical polymerization: Subtle revolution in tackling a long-standing challenge

(2009) Christopher Barner-Kowollik et al.   PROGRESS IN POLYMER SCIENCE

Model-based design and synthesis of gradient MMA/tBMA copolymers by computer-programmed semibatch atom transfer radical copolymerization

(2008) Ying Zhao et al.   JOURNAL OF POLYMER SCIENCE PART A-POLYMER CHEMISTRY