2 papers
cs.AI2026
Confidence is the key: how conformal prediction enhances the generative design of permeable peptides
Laura van Weesep, Sunay Chankeshwara, Leonardo De Maria +3
Generative models coupled with reinforcement learning (RL), such as REINVENT and PepINVENT, have emerged as a powerful framework for de novo molecular design. During the ideation p…
q-bio.BM2024
PepINVENT: Generative peptide design beyond the natural amino acids
Gökçe Geylan, Jon Paul Janet, Alessandro Tibo +7
Peptides play a crucial role in the drug design and discovery whether as a therapeutic modality or a delivery agent. Non-natural amino acids (NNAAs) have been used to enhance the p…