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. 2019 Mar 28;59(4):1410–1421. doi: 10.1021/acs.jcim.8b00820

Table 9. Distances between Molecules Shown in Table 8 Computed Using the FP-Based, SED-Based, and GED-Based Similarity Methods.

  Mol ID 2 ligand Mol ID 3 decoy
Mol ID 1 ligand SED: 0.06 SED: 0.28
FPD: 0.40 FPD: 0.92
GED: 0.49 GED: 3.05