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. Author manuscript; available in PMC: 2018 Apr 24.
Published in final edited form as: J Chem Inf Model. 2017 Apr 11;57(4):942–957. doi: 10.1021/acs.jcim.6b00740

Figure 14.

Figure 14

ROC plot for discriminating low RMSD from high RMSD poses generated from the PDBbind core set. The CSAR-trained CNN performs best at classifying generated poses as low or high RMSD across targets, with a steep initial slope evincing good performance at early recognition.