New Tutorial: Using CrypticScout To Find Binding Pockets In A Protein
Playmolecule tutorial
In this tutorial we will get to know how to use CrypticScout one of the apps included in PlayMolecule, Acellera’s drug discovery platform.
CrypticScout is an application that leverages mixed-solvent Molecular Dynamics (MD) simulations to unravel protein binding sites, both pre-formed and hidden. These hidden cavities, known as “cryptic sites”, usually remain closed in apo crystal structures but their role in protein-protein interactions or in selective modulation of protein activity makes them very interesting in drug discovery.
Follow this tutorial to explore our app!