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Review Open access Aug 2026

Diffusion-Based Protein Structure Design: Geometric Modelling, Validation Strategies, and Thermodynamic Challenges

This review focuses on coordinate- and residue-frame-based diffusion approaches for generating protein structures, paying particular attention to geometric equivariance, conditioning strategies, all-atom modelling and interaction-aware design.

Wen-Ran Li, Xavier F. Cadet, David Medina-Ortiz et al. · 0 citations