Call for Papers: AI in Drug Discovery Workshop @ ICANN 2025
Call for papers for the Second Workshop on AI in Drug Discovery at ICANN 2025, covering topics like Explainable AI, Generative models, and more.
Join the Second Workshop on AI in Drug Discovery, held in conjunction with ICANN 2025, on September 11, 2025, in Vienna. This workshop aims to bridge AI and chemistry, highlighting challenges and innovations in ML-driven drug discovery.
Key topics include:
- Explainable AI (XAI)
- Generative models
- Model distillation & privacy
- Uncertainty quantification
- Reaction informatics & synthetic route prediction
- Quantum ML for reactivity
- HTS data analysis, frequent hitter detection
- Large compound dataset mining
Important dates:
- Full papers/extended abstracts deadline: April 15, 2025
- Extended abstract (only) deadline: May 1, 2025
- Notification: May 15, 2025
- Camera-ready: June 15, 2025
Submit your work through the ICANN 2025 Submission Site https://e-nns.org/icann2025/submission and select track: ‘Workshop: AI in Drug Discovery’. Don’t miss the opportunity to participate in the upcoming Tox25 Challenge and post-workshop publication opportunities.
Organizers: Igor Tetko (Helmholtz Munich), Djork-Arné Clevert (Pfizer)
More information: https://aichemist.eu
Tags: AI in Drug Discovery, ICANN 2025, Machine Learning, Chemistry, ML-driven drug discovery, Workshop, Call for Papers