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Bioengineer
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Image Credit: Bioengineer
St. Jude Algorithm Harnesses Water Dynamics to Accelerate Drug Discovery
- St. Jude scientists unveil ColdBrew algorithm illuminating water's role in drug discovery.
- ColdBrew refines protein-ligand interactions by predicting water displacement in binding sites.
- Tool corrects cryo-induced artifacts, aids rational ligand design, democratizes water displacement insights.
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