Can we still trust docking results? an extension of the applicability of dockbench on pdbbind database

HIGHLIGHTS

  • who: Giovanni Bolcato and collaborators from the University of Padova, Padova, Italy have published the research: Can We Still Trust Docking Results? An Extension of the Applicability of DockBench on PDBbind Database, in the Journal: (JOURNAL)
  • what: The authors report a large benchmark performed on the containing more than four thousand entries and seventeen popular docking protocols.

SUMMARY

    Since its introduction in the early 1980s, molecular docking has served to aid medicinal computational chemists in optimizing the drug discovery process. A docking protocol can be described as the combination of a . . .

     

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