Figure 5
From: CheS-Mapper 2.0 for visual validation of (Q)SAR models
The COX-2 dataset is clustered into 7 clusters. The compounds are highlighted according to their cluster assignment. Cluster 3 is selected (as indicated by the box), and the a summary of feature values is shown on the right-hand side. Spheres are employed for highlighting (instead of changing the color of the structure).