Francesca Grisoni
Eindhoven, NB, Netherlands
Last Updated: 09/26/2026
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Found 78 publications
Artificial intelligence in drug discovery - what it is, where we stand and the path forward.
Journal: Nature reviews. Drug discovery
Published: June 20, 2026
Beyond Molecular Structures: Investigating Demographic Factors in Drug-Induced Cardiotoxicity Prediction Models.
Journal: Journal of chemical information and modeling
Published: June 02, 2026
Machine learning for biomolecular modeling.
Journal: The Journal of chemical physics
Published: February 18, 2026
"Visualize, Describe, Compare"─Nanoinformatics Approaches for Material-Omics.
Journal: ACS nano
Published: January 21, 2026
Enhancing deep chemical reaction prediction with advanced chirality and fragment representation.
Journal: Chemical communications (Cambridge, England)
Published: September 11, 2025
Molecular deep learning at the edge of chemical space.
Journal: Nature machine intelligence
Published: August 01, 2025
Generative Deep Learning for de Novo Drug Design─A Chemical Space Odyssey.
Journal: Journal of chemical information and modeling
Published: July 09, 2025
How evaluation choices distort the outcome of generative drug discovery.
Journal: Journal of cheminformatics
Published: July 06, 2025
Scaffold Hopping with Generative Reinforcement Learning.
Journal: Journal of chemical information and modeling
Published: June 26, 2025
Deep Supramolecular Language Processing for Co-Crystal Prediction.
Journal: Angewandte Chemie (International ed. in English)
Published: April 09, 2025
Identifying 14-3-3 interactome binding sites with deep learning.
Journal: Digital discovery
Published: March 31, 2025
The Chemistry and Biology of the Tetrodotoxin Natural Product Family.
Journal: Angewandte Chemie (International ed. in English)
Published: January 28, 2025
Last Updated: 09/26/2026