Freija De Vleeschouwer
17PUBLICATIONS
23CO-AUTHORS
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Publications (17)
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|Nov 21, 2025
Conceptual DFT Meets Machine Learning: A New Route to Enhanced Diels-Alder Reactivity.Michiel Jacobs, Lise Vermeersch, Freija De Vleeschouwer
|Oct 30, 2025
Deploying Pictet-Spengler Reactions to Access Constrained Aromatic Amino Acids.Jolien De Neve, Bin Wang, Khadija Ngom
|Oct 15, 2025
Predicting pesticide vapour pressures: the power of functional groups.Mark Heezen, Manuel Alcamí, Clemens Rauer
|Nov 20, 2024
Computational Insights into Tunable Reversible Network Materials: Accelerated ReaxFF Kinetics of Furan-Maleimide Diels-Alder Reactions for Self-Healing and Recyclability.L Vermeersch, T Wang, N Van den Brande
|Nov 12, 2024
Deciphering nonlinear optical properties in functionalized hexaphyrins via explainable machine learning.Eline Desmedt, Michiel Jacobs, Mercedes Alonso
|Jun 18, 2024
Aromaticity in the Spectroscopic Spotlight of Hexaphyrins.Eline Desmedt, Irene Casademont-Reig, Roger Monreal-Corona
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Frequent Collaborators
4 joint publications
Lise Vermeersch
4 joint publications
Mercedes Alonso
4 joint publications
Eline Desmedt
2 joint publications
Kristof Van Hecke
2 joint publications
Guido Verniest
2 joint publications
Michiel Jacobs
1 joint publications
A C T van Duin
1 joint publications
Steven Ballet
1 joint publications
Balazs Pinter
1 joint publications
Vineet Pande
