Showing results (1-10 of 76) with videos related to
Sort By:
Pageof 8
Nature Computational Science|September 28, 2024
Traversing chemical space with active deep learning for low-data drug discoveryDerek van Tilborg, Francesca GrisoniNature Machine Intelligence|April 27, 2026
Molecular deep learning at the edge of chemical spaceDerek van Tilborg, Luke Rossen, Francesca GrisoniJournal of Chemical Information and Modeling|December 1, 2022
Exposing the Limitations of Molecular Machine Learning with Activity CliffsDerek van Tilborg, Alisa Alenicheva, Francesca GrisoniCurrent Opinion in Structural Biology|April 26, 2024
Deep learning for low-data drug discovery: Hurdles and opportunitiesDerek van Tilborg, Helena Brinkmann, Emanuele Criscuolo, et al.Cancers|January 26, 2021
Cancers in Agreement? Exploring the Cross-Talk of Cancer Metabolomic and Transcriptomic Landscapes Using Publicly Available DataDerek van Tilborg, Edoardo SaccentiCurrent Opinion in Structural Biology|February 4, 2023
Chemical language models for de novo drug design: Challenges and opportunitiesFrancesca GrisoniChimia|December 30, 2019
De novo Molecular Design with Generative Long Short-term MemoryFrancesca Grisoni, Gisbert SchneiderDigital Discovery|December 27, 2024
A hitchhiker's guide to deep chemical language processing for bioactivity predictionRıza Özçelik, Francesca GrisoniMethods in Molecular Biology (Clifton, N.J.)|March 24, 2021
Molecular Scaffold Hopping via Holistic Molecular RepresentationFrancesca Grisoni, Gisbert SchneiderJournal of Cheminformatics|November 13, 2025
How evaluation choices distort the outcome of generative drug discoveryRıza Özçelik, Francesca GrisoniPageof 8