DISCO
Joint sequence-structure co-design with ligand and RNA conditioning
DISCO (DIffusion for Sequence-structure CO-design) jointly generates protein sequences and 3D structures conditioned on arbitrary biomolecules, including small-molecule ligands, DNA and RNA. Joint modeling lets sequence objectives inform structure generation and vice versa. Demonstrated on binder design and new-to-nature heme enzyme catalysis.
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At a glance
- Input
- Target and ligands (PDB, SDF)
- Output
- Co-designed complexes (PDB)
- Developed by
- Mila
- Published
- Rector-Brooks et al., 2025 · 2025
#co-design#diffusion#binder-design
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