Figure 3From: A rotation-translation invariant molecular descriptor of partial charges and its use in ligand-based virtual screening1st, 2nd and 3rd quartile plots for ACPC , MACCS, Pharao and Shape-it on all queries of the “1conf” dataset. For clarity, targets are sorted on the x axis by decreasing median value obtained by ACPC. The red dotted horizontal line at AUC = 0.5 indicates random performance.Back to article page