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In this CCDC Virtual Workshop, you will learn the basics of how to perform Protein Ligand Docking using GOLD.
We will cover:
The basics of GOLD and our Hermes interface.
How to run a standard protein ligand dock.
How to identify the correct binding modes reliably and with confidence.
The basics of how GOLD can be used in virtual screening and lead optimisation.
This session will last 90 minutes, inclusive of time to try the hands-on part. At the end, our expert tutors will be available an extra 15 minutes, should you need to complete the exercises or wish to try more or ask more questions.
Requirements
This is an entry-level session so anyone can join, but some knowledge of docking and drug discovery would be useful.
The CSD Software installed and an active CSD-Discovery (or above*) license. (*CSD-Discovery, or CSD-Enterprise).
