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Database of chemical structures of substances generally recognized as safe from the Computer Aided Science research group

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https://zenodo.org/record/7999923
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资源简介:
The databank of chemical structures was populated by drawing the two-dimensional structures of the Generally Recognised as Safe obtained by the list of the regulatory agency, Food and Drug Administration (FDA, http://www.fda.gov), n = 364 and from the Flavour and Extract Manufacturers Association (FEMA, https://www.femaflavor.org/), n = 2,500 in 2019. This databank was used to write the article "Evaluation of general toxicity in food constituents using in silico tools. Rev. Virtual Quim., 2019, 11 (2), 543-553.
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2023-06-19
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