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. 2016 Sep 29;8:51. doi: 10.1186/s13321-016-0162-2

Table 2.

ER-LBD Active compounds correctly predicted in External set using RF and NB models using MACCS and ECFP4 fingerprints

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The values correspond to the prediction scores for a compound to be active

Colour denotes different molecules illustrated in the Fig. 4