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Generative AI drug discovery breakthrough, with Alex Zhavoronkov

London Futurists

CHAPTER

The Importance of Diversity in Chemistry

Diversity in chemistry is extremely important and novelty. Some models can produce really great chemistry that satisfies your desired conditions but the molecules are not going to be super novel or super diverse. After 72 hours many of those models that are warmed up with the reinforcement learning ensemble usually they start producing really good molecules then you give each model a chance.

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