Projects per year
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Dive into the research topics where Freija De Vleeschouwer is active. These topic labels come from the works of this person. Together they form a unique fingerprint.
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Collaborations and top research areas from the last five years
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SRP73: SRP-Onderzoekszwaartepunt: Understanding, predicting, and tailoring molecular and material properties and reactivity through combined conceptual and computational quantum chemical approaches
De Proft, F. (Administrative Promotor), Tielens, F. (Co-Promotor), Alonso Giner, M. (Co-Promotor) & De Vleeschouwer, F. (Co-Promotor)
1/11/22 → 31/10/27
Project: Fundamental
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FWOTM1148: Accelerating the Diels-Alder kinetics of self-healing polymer network: new insights from a combined density functional theory and molecular dynamics approach
De Vleeschouwer, F. (Administrative Promotor), Van den Brande, N. (Co-Promotor) & Vermeersch, L. (Mandate)
1/11/22 → 30/06/26
Project: Fundamental
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OZR3835: Backup mandate Research Council: Understanding and accelerating the Diels-Alder kinetics of self- healing polymer networks using a combined density functional theory and molecular dynamics approach
De Vleeschouwer, F. (Administrative Promotor) & Vermeersch, L. (Mandate)
1/11/21 → 31/10/22
Project: Fundamental
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FWOTM1013: Rational molecular design of photoswitches for nonlinear optical applications
Desmedt, E. (Mandate), Alonso Giner, M. (Administrative Promotor) & De Vleeschouwer, F. (Scientific Promotor)
1/11/20 → 31/10/24
Project: Fundamental
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FWOTM567: Development, implementation and application of the design of molecules with optimal properties within the framework of conceptual density functional theory.
De Vleeschouwer, F. (Administrative Promotor) & Geerlings, P. (Co-Promotor)
1/10/10 → 30/09/16
Project: Fundamental
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A Comprehensive Methodology for Developing Dynamic Polymer Networks: Combining Computational Predictions, Synthesis, and Characterization
Mangialetto, J., Vermeersch, L., Pan, R., De Vleeschouwer, F., Hennecke, U. & Van den Brande, N., 26 May 2025. 1 p.Research output: Unpublished contribution to conference › Poster
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Breaking Down the Building Blocks: Quantum Chemical Analysis of Diels–Alder Reactions for Future Self-Healing and Recyclable Polymer Networks
Vermeersch, L., Verhelle, R., Brande, N. V. D. & Vleeschouwer, F. D., 14 Jan 2025, In: Macromolecules. 58, 1, p. 32-44 13 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile8 Citations (Scopus)24 Downloads (Pure) -
Conceptual DFT Meets Machine Learning: A New Route to Enhanced Diels–Alder Reactivity
Jacobs, M., Vermeersch, L. & Vleeschouwer, F. D., 5 Dec 2025, In: Journal of Computational Chemistry. 46, 31, 14 p., e70277.Research output: Contribution to journal › Article › peer-review
1 Citation (Scopus) -
Deploying Pictet-Spengler reactions to access constrained aromatic amino acids
De Neve, J., Wang, B., Ngom, K., Lecomte, H. S., Iaculli, D., Hollanders, C., De Proft, F., De Vleeschouwer, F. & Ballet, S., 14 Nov 2025, In: The Journal of Organic Chemistry. 90, 45, p. 16082-16089 8 p.Research output: Contribution to journal › Article › peer-review
1 Citation (Scopus)14 Downloads (Pure) -
Experimental Development of Self-Healing Polymer Networks Supported by DFT Calculations
Mangialetto, J., Vermeersch, L., Pan, R., De Vleeschouwer, F., Hennecke, U. & Van den Brande, N., 7 Dec 2025, In: Macromolecules. 58, 24, p. 13412-13428 17 p.Research output: Contribution to journal › Article › peer-review
2 Downloads (Pure)
Prizes
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FWO postdoctoral fellowship (1227014N): “Development, Implementation and Application of the Design of Molecules with Optimal Properties within the Framework of Conceptual Density Functional Theory”
De Vleeschouwer, F. (Recipient), 2010
Prize: Fellowship awarded competitively
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FWO postdoctoral fellowship (1227014N): “Inverse Molecular Design in Stable Radical Chemistry: Optimizing Molecular Properties within the Framework of Conceptual Density Functional Theory”
De Vleeschouwer, F. (Recipient), 2013
Prize: Fellowship awarded competitively
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Poster prize at the 15th International Congress of Quantum Chemistry (ICQC), Beijing, China
De Vleeschouwer, F. (Recipient), 13 Jun 2015
Prize: Prize (including medals and awards)
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Research Professor in Basic, Nature & Applied Sciences (0.1 ZAP)
De Vleeschouwer, F. (Recipient), 1 Oct 2020
Prize: Appointment
Activities
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Chemistry (Organisational unit)
Eeckhoudt, J. (Speaker), De Proft, F. (Supervisor), Alonso Giner, M. (Supervisor), Hennecke, U. (Chair), De Vleeschouwer, F. (Jury), Martin, C. (Jury), Vranken, W. (Jury), Matito, E. (Jury), Neudecker, T. (Jury) & Rahm, M. (Jury)
11 Dec 2025Activity: Membership › Member of PhD committee
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Pharmaceutical and Pharmacological Sciences (Organisational unit)
Peeters, J. (Speaker), Vanommeslaeghe, K. (Supervisor), Massie, A. (Chair), De Vleeschouwer, F. (Jury), De Winter, H. (Jury), Verstraelen, T. (Jury) & Vorobieva, A. A. (Jury)
22 Dec 2025Activity: Membership › Member of PhD committee
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Chemical space exploration towards novel and redox-active quinones for redox flow batteries
De Vleeschouwer, F. (Speaker)
2024Activity: Talk or presentation › Talk or presentation at a conference
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Chemistry (Organisational unit)
De Neve, J. (Speaker), Ballet, S. (Supervisor), De Proft, F. (Chair), Hennecke, U. (Jury), De Vleeschouwer, F. (Chair), De Bundel, D. (Jury), Simonin, F. (Jury) & Larregola, M. (Jury)
25 Sept 2024Activity: Membership › Member of PhD committee
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Chemistry (Organisational unit)
Van holsbeeck, K. (Speaker), Hernot, S. (Chair), Hennecke, U. (Jury), Ballet, S. (Supervisor), Martins, J. C. (Jury), De Vleeschouwer, F. (Jury), Madder, A. (Jury), Gruber, C. (Jury) & De Borggraeve, W. (Jury)
16 May 2023Activity: Membership › Member of PhD committee