AI for molecular modeling and protein design - Eva Smorodina

AI has made molecular modeling much faster. Now, tasks that previously could take many months can be done within hours – and here I primarily mean protein structure prediction and design. In this talk, we’ll cover how AI has changed traditional state-of-the-art approaches and discuss what tools you can use to speed up your computational structural research. I'll go through specific methods, compare their strengths and weaknesses, and provide examples where AI have succeeded or failed.