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A universal system for digitization and automatic execution of the chemical synthesis literature

S. Hessam M. Mehr, Matthew Craven, Artem I. Leonov, Graham Keenan, Leroy Cronin

发表年份
2020
引用次数
271

摘要

Robotic systems for chemical synthesis are growing in popularity but can be difficult to run and maintain because of the lack of a standard operating system or capacity for direct access to the literature through natural language processing. Here we show an extendable chemical execution architecture that can be populated by automatically reading the literature, leading to a universal autonomous workflow. The robotic synthesis code can be corrected in natural language without any programming knowledge and, because of the standard, is hardware independent. This chemical code can then be combined with a graph describing the hardware modules and compiled into platform-specific, low-level robotic instructions for execution. We showcase automated syntheses of 12 compounds from the literature, including the analgesic lidocaine, the Dess-Martin periodinane oxidation reagent, and the fluorinating agent AlkylFluor.

关键词

DigitizationComputer scienceOxidizing agentProcess (computing)SoftwareChemistNatural productCode (set theory)Product (mathematics)Programming language

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