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Fig. 7 | Journal of Cheminformatics

Fig. 7

From: An algorithm to classify homologous series within compound datasets

Fig. 7

Examples of two series classified by OngLai that belong to the same splitPFAS series because they have the same X and R groups in CnF2n+1-X-R according to splitPFAS results. Labels correspond to the ID_in_OECD_list and CAS Registration Number given in the splitPFAS results XLSX file respectively; molecules from the splitPFAS dataset (series_no = 0 and 1, Additional file 1: Sect. 2)

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