Research Explorer

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Researcher

Gilles Desmet

Awards & Distinctions

13 Results

2018

Ab-initio-based kinetic modeling to understand RAFT exchange : the case of 2-Cyano-2-Propyl Dodecyl Trithiocarbonate and Styrene

Gilles DesmetNils De RybelPaul Van SteenbergeDagmar D'hoogeMarie-Françoise ReyniersGuy Marin

A1 Journal Article in MACROMOLECULAR RAPID COMMUNICATIONS

2017

Ab initio based kinetic Monte Carlo analysis to unravel the propagation kinetics in vinyl acetate pulsed laser polymerization

Gilles DesmetYoshi MarienPaul Van SteenbergeDagmar D'hoogeMarie-Françoise ReyniersGuy Marin

A1 Journal Article in POLYMER CHEMISTRY

Ab initio based modeling for the synthesis of RAFT polymers and their modifications

Gilles DesmetMarie-Françoise ReyniersGuy Marin

Thiol-Michael addition in polar aprotic solvents : nucleophilic initiation or base catalysis?

Gilles DesmetMaarten SabbeDagmar D'hoogePieter EspeelSensu CelasunGuy MarinFilip Du PrezMarie-Françoise Reyniers

A1 Journal Article in POLYMER CHEMISTRY

2016

Computational Investigation of the Aminolysis of RAFT Macromolecules

Gilles DesmetDagmar D'hoogeMaarten SabbeMarie-Françoise ReyniersGuy Marin

A1 Journal Article in JOURNAL OF ORGANIC CHEMISTRY

Computational and kinetic study of the thiol and aza Michael addition

Gilles DesmetDagmar D'hoogeMaarten SabbeGuy MarinFilip Du PrezMarie-Françoise Reyniers

Quantitative first principles based kinetic modeling for the synthesis of well-defined macromolecular architectures

Gilles DesmetDagmar D'hoogeMaarten SabbeGuy MarinMarie-Françoise Reyniers

Quantitative first-principles kinetic modeling of the aza-Michael addition to acrylates in polar aprotic solvents

Gilles DesmetDagmar D'hoogePinar Sinem OmurtagPieter EspeelGuy MarinFilip Du PrezMarie-Françoise Reyniers

A1 Journal Article in JOURNAL OF ORGANIC CHEMISTRY

2015

Computational study and kinetic analysis of the aminolysis of thiolactones

Gilles DesmetDagmar D'hoogeMaarten SabbeGuy MarinFilip Du PrezPieter EspeelMarie-Françoise Reyniers

A1 Journal Article in JOURNAL OF ORGANIC CHEMISTRY

Computational study of the aminolysis of thiolactones

Gilles DesmetDagmar D'hoogePieter EspeelGuy MarinFilip Du PrezMarie-Françoise Reyniers

Kinetic study of the Aminolysis of Thiolactones

Gilles DesmetDagmar D'hoogeMaarten SabbeGuy MarinFilip Du PrezPieter EspeelMarie-Françoise Reyniers

2014

Multi-scale Modeling of the Polymerization of Thiolactone Containing Monomers based on Amine-Thiol-Ene Conjugation Chemistry

Gilles DesmetLawrence VanhoyeF. GoehtalsDagmar D'hoogePieter EspeelFilip Du PrezGuy MarinMarie-Françoise Reyniers

Multi-scale modeling of amine-thiol-ene conjugation chemistry for macromolecular design

Gilles DesmetLawrence VanhoyeFabienne GoethalsD D'HoogePieter EspeelGuy MarinFilip Du PrezMarie-Françoise Reyniers