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Journal of Chemical Information and Modeling|October 2, 2025
VeGA: A Versatile Generative Architecture for Bioactive Molecules across Multiple Therapeutic TargetsPietro Delre, Antonio LavecchiaJournal of Chemical Information and Modeling|April 17, 2026
VeGA-RX and VeGA-SCX: Controllable SMARTS-Guided Generative Transformers for Precision-Driven De Novo Drug DesignPietro Delre, Giada Bellofatto, Antonio LavecchiaACS Omega|April 14, 2025
From Apo to Ligand-Bound: Unraveling PPARγ-LBD Conformational Shifts via Advanced Molecular DynamicsEmanuele Falbo, Pietro Delre, Antonio LavecchiaDrug Discovery Today|October 12, 2025
Artificial intelligence in the development of small nucleic acid therapeutics: toward smarter and safer medicinesPietro Delre, Carmen Cerchia, Antonio LavecchiaDrug Discovery Today|August 5, 2019
Deep learning in drug discovery: opportunities, challenges and future prospectsAntonio LavecchiaDrug Discovery Today|June 26, 2024
Advancing drug discovery with deep attention neural networksAntonio LavecchiaCell Host & Microbe|October 9, 2025
Deep learning helps fight against antibiotic resistanceAntonio LavecchiaDrug Discovery Today|December 3, 2014
Machine-learning approaches in drug discovery: methods and applicationsAntonio LavecchiaDrug Discovery Today|April 23, 2026
Physics-inspired explainable AI for mechanistic and decision support in drug discoveryAntonio LavecchiaDrug Discovery Today|August 5, 2024
Navigating the frontier of drug-like chemical space with cutting-edge generative AI modelsAntonio LavecchiaPageof 19