Set-theoretic formalism for treating ligand-target datasets

HIGHLIGHTS

• who: Gerald Maggiora and Martin Vogt from the , Institute, University of Arizona, Tucson, AZ, USA have published the article: Set-Theoretic Formalism for Treating Ligand-Target Datasets, in the Journal: Molecules 2021, 26, x FOR PEER REVIEW of /2021/
• what: If the analysis is threshold-based, LT pairs whose activity/interaction value is equal to or exceeds a given threshold are considered to be ‘active pairs' and are assigned a value of unity. This has important consequences for the potential magnitude of polypharmacologies, which this work shows may be severely underestimated. The approach described in . . .
  

   

  

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