Results of scoring decoys from the dataset of Baker and coworkers [15].
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[a]“Unbound perturbation” dataset. 54 targets were scored with 1000 decoys each. Scoring criteria were applied according to Baker and coworkers: “N10Å” is the percentage of complexes that have at least three top five decoys with rmsd [b]“Unbound docking” dataset. 54 targets were scored with 200 decoys each. To identify the top 10 solutions, the best scored decoys from the top 10 clusters were considered (see Materials & Methods). Scoring criteria were applied according to Baker and coworkers: “R5Å” (“R10Å”) is the percentage of complexes that have at least one solution [c]Not determined.[d]For reasons of comparison with the paper of Baker and coworkers both values are given although they are redundant.
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2015-12-02



