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Alexandre Duplessis

3 accepted papers

2026

MacroGuide: Topological Guidance for Macrocycle Generation

ICML 2026poster

Macrocycles are ring-shaped molecules that offer a promising alternative to small-molecule drugs due to their enhanced selectivity and binding affinity against difficult targets. Despite their chemical value, they remain underexplored in generative modeling, likely owing to their scarcity in public …

Cited by 0SourceScholar
2024

On the Stability of Iterative Retraining of Generative Models on their own Data

ICLR 2024spotlight

Deep generative models have made tremendous progress in modeling complex data, often exhibiting generation quality that surpasses a typical human's ability to discern the authenticity of samples. Undeniably, a key driver of this success is enabled by the massive amounts of web-scale data consumed by…