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. 2020 May 5;60(6):2858–2875. doi: 10.1021/acs.jcim.0c00161

Figure 12.

Figure 12

Ranks obtained for the targets of interest as a function of the size of the MCS shared between the CSM queries and most similar ligand (non-CSM) recorded for the respective target for the (a) TanimotoCombo, (b) RefTverskyCombo, (c) FitTverskyCombo, and (d) ShapeTanimoto scores. The lines are merely a guide for the eye and indicate the median values of the target rankings in relation to the size of the MCS.