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Table S1. The details of the dataset used to build models.

Table S2. Details of the external validation set molecules.

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FilenameFormatSizeDescription
CBDD_894_sm_Table S1-S2.doc170KSupporting info item

Please note: Wiley Blackwell is not responsible for the content or functionality of any supporting information supplied by the authors. Any queries (other than missing content) should be directed to the corresponding author for the article.