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Automation and computer-assisted planning for chemical synthesis

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This PrimeView highlights the most relevant aspects of information theory that facilitate automation and prediction for chemical synthesis. This summary provides an overview of the software, hardware and data and how these are used to enable retrosynthetic logic, reaction prediction and automation.

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Automation and computer-assisted planning for chemical synthesis. Nat Rev Methods Primers 1, 24 (2021). https://doi.org/10.1038/s43586-021-00026-1

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