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AI Modeling + Molecular Docking Simulation
Project Type
Mechanism of Action
We identified a new TRPC6 inhibitor that is both specific and bioavailable. Yet, we do not understand the mechanism-of-action. To answer this question, we have combined traditional molecular docking simulations with the latest AI-powered protein modeler (AlphaFold3) to investigate where the new TRPC6 inhibitor binds and what the inhibitor does to TRPC6 structure.
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