Figure 2From: Exploring the binding of BACE-1 inhibitors using comparative binding energy analysis (COMBINE)Scatter plot comparing experimental vs. predicted activities in COMBINE models for the 46 compounds of the training series and the test series. A. The 3-PC distance-dependent dielectric constant model (built from a single X-ray crystal structure). B. The 5-PC sigmoidal electrostatic model (built from the actual complexes present in the PDB).Back to article page