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Lean-Docking: Exploiting Ligands’ Predicted Docking Scores to Accelerate Molecular Docking

Journal of Chemical Information and Modeling, 2021
In structure-based virtual screening (SBVS), a binding site on a protein structure is used to search for ligands with favorable nonbonded interactions. Because it is computationally difficult, docking is time-consuming and any docking user will eventually encounter a chemical library that is too big to dock.
Francois Berenger   +3 more
openaire   +2 more sources

Docking proteins

The FEBS Journal, 2010
Docking proteins comprise a distinct category of intracellular, noncatalytic signalling protein, that function downstream of a variety of receptor and receptor‐associated tyrosine kinases and regulate diverse physiological and pathological processes. The growth factor receptor bound 2‐associated binder/Daughter of Sevenless, insulin receptor substrate,
Tilman, Brummer   +2 more
openaire   +2 more sources

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