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Scoring functions prediction

Raha K, Merz KM. Large-scale validation of a quantum mechanics based scoring function predicting the binding affinity and the binding mode of a diverse set of protein-ligand complexes. J Med Chem 2005 48 4558-75. [Pg.349]

Gohlke H, Hendlich M, Klebe G. Knowledge-based scoring function to predict protein-ligand interactions. J Mol Biol 2000 295 337-56. [Pg.416]


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See also in sourсe #XX -- [ Pg.408 , Pg.409 , Pg.410 , Pg.411 , Pg.412 , Pg.413 ]




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