From the source
Isomorphic Labs introduced the Isomorphic Labs Drug Design Engine (IsoDDE), a unified computational drug-design system that demonstrates improved predictive accuracy over AlphaFold 3.
On a protein-ligand structure prediction benchmark, IsoDDE more than doubles AlphaFold 3's accuracy on the most difficult systems.
It also outperforms AlphaFold 3 by 2.3x and Boltz-2 by 19.8x on a challenging antibody-antigen test set, and surpasses all deep-learning methods on three binding affinity prediction benchmarks.
