A universal system for digitization and automatic execution of the chemical synthesis literature
Science, 2020. [All Versions]. [Preprint]. [XDL Documentation]. [XDL Schema Database]. This paper reports a software platform that uses natural language processing to translate the organic chemistry literature directly into editable code, which in turn can be compiled to drive…
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Digitization and validation of a chemical synthesis literature database in the ChemPU science.org
Science, 2022. [All Versions]. [Preprint]. This paper presents an automatically executable chemical reaction database of 100 molecules representative of the range of reactions found in contemporary organic synthesis. The chemical reaction codes or χDLs for the reactions have…
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Organic synthesis in a modular robotic system driven by a chemical programming language science.org
Science, 2019. [All Versions]. [Preprint]. [Perspective: Democratizing synthesis by automation]. This paper develops an autonomous compiler and robotic laboratory platform to synthesize organic compounds on the basis of standardized methods descriptions. The platform comprises…
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Universal chemical programming language for robotic synthesis repeatability nature.com
Nature Synthesis, 2024. [All Versions]. [Preprint]. The amount of chemical synthesis literature is growing quickly; however, it takes a long time to share and evaluate new processes among laboratories. This paper presents an approach that uses a universal chemical programming…
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Automated extraction of chemical synthesis actions from experimental procedures nature.com
Nature Communications, 2020. [All Versions]. This paper presents a method to convert unstructured experimental procedures written in English to structured synthetic steps (action sequences) reflecting all the operations needed to successfully conduct the corresponding chemical…
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An autonomous portable platform for universal chemical synthesis nature.com
Nature Chemistry, 2022. [All Versions]. [Preprint]. This paper presents a portable suitcase-sized chemical synthesis platform containing all the modules required for synthesis and purification. The system uses a chemical programming language coupled to a digital reactor…
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Inferring experimental procedures from text-based representations of chemical reactions nature.com
Nature Communications, 2021. [All Versions]. This paper presents data-driven models for predicting the entire sequence of synthesis steps starting from a textual representation of a chemical equation, for application in batch organic chemistry.
AGI & CoCoSci › Papers > Science Logology > Laboratory Automation: “Science, 2020. [All Versions]. [Preprint]. [XDL Documentation]. [XDL Schema Database]. This paper reports a software platform that uses natural language processing to translate the organic chemistry literature directly into editable code, which in turn can be compiled to drive…”