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. 2020 Jul 31;10:12982. doi: 10.1038/s41598-020-70026-w

Figure 2.

Figure 2

Examples of atom highlighting derived from Bayesian models. The molecules not in each model were tested with (A) Broad, (B) Broad + EGFR and (C) EGFR models. Molecules shown are: AZD2014 (top), RDEA119 (middle), AZD4054 (bottom) on each panel. Images were generated in Assay Central (Collaborations Pharmaceuticals, Inc.).