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Accelerating drug discovery with AI: Insights from Isomorphic Labs

Gradient Dissent: Conversations on AI

CHAPTER

Exploring the Role of Data in AI-driven Drug Discovery

Exploring the value of diverse datasets, including public resources like the Protein Data Bank, in training AI models for drug discovery programs. The chapter emphasizes the necessity of dataset diversity to cover a broad chemical space and achieve high performance in synthesizing data for drug-like molecules.

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