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quarantine-receptors

mpro-1

This is the "Mpro" protease of Sars-cov2, whose structure was recently determined and released by the Walsh group :

https://twitter.com/MartinWalshDLS/status/1236355083585179648

The docking task is to find small-molecule binders of the active site.

mpro-1

Sars-cov2 Spike protein

Ideally, if we found small molecules that bind to the contact surface between spike protein and human ACE2, we may block its spread in the body

spike-1