Author

A. Bonvin

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Open access Sep 2026

MIMOSA: Guiding De Novo Antibody Design with Natural Interaction Fingerprints

De novo antibody design promises to transform therapeutic antibody and nanobody discovery. Yet, success remains inconsistent across targets, with generative models often yielding no experimentally validated binders. Here we introduce MIMOSA (MIMic-Oriented Structural Antibody generation), a model-agnostic, inference-ti...

Brennan Abanades, Andrea Roncoli, Maniraj Bhagawati et al. · bioRxiv · 0 citations

Open access Oct 2026

Mapping Functional Transitions across Protein Homologues from a Single Simulation: Application of gEDES-HM to Adenylate Kinases

Proteins fluctuate across different conformational states, which constitute a dynamic ensemble that regulates their interaction networks and functions. Predicting the conformational landscape remains a computational challenge, and even more difficult is capturing the link between state distributions and specific func...

Han Kurt, Mohd Athar, Andrea Basciu et al. · Journal of Chemical Informat... · 0 citations