Extraction of chemical structures from literature and patent documents using open access chemistry toolkits: a case study with PFAS

Shadrack J. Barnabas, Timo Böhme, Stephen Boyer, Matthias Irmer, Christoph Ruttkies, Ian Wetherbee, Todor Kondić, Emma Schymanski, Lutz Weber

Digital Discovery · 2022 · 30 citations · 16 references

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Abstract

Extracting PFAS with open source cheminformatics toolkits reveals ∼1.78 million PFAS in Google Patents, ∼28 K in the CORE literature repository.

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