Fig. 11
From: Multi-objective de novo drug design with conditional graph generative model
Distribution of QED and SAscore for generated results: the upper row indicates distribution of QED and SAscore of molecules generated under conditions \(C_1\), \(C_2\) , \(C_3\) and \(C_4\). The conditions \(C_1\sim C_4\) are shown as intervals represented by error bar. The lower row indicates distribution of QED and SAscore of molecules generated using single point conditions (\({\mathbf{c}}_{\mathbf{1}}\), \({\mathbf{c}}_{\mathbf{2}}\), \({\mathbf{c}}_{\mathbf{3}}\) and \({\mathbf{c}}_{\mathbf{4}}\)). The conditions \({\mathbf{c}}_{\mathbf{1}}\sim {\mathbf{c}}_{\mathbf{4}}\) are represented as dots in the plot