Figure_2.tif (1.39 MB)
Correlation between observed pIC50 and predicted binding energy based on the Glide scores (A), scenario 1 (B), scenario 2 and 3 (C), and modified Chelation Score (D).
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posted on 2014-06-04, 14:43 authored by Vasanthanathan Poongavanam, Casper SteinmannCasper Steinmann, Jacob KongstedCorrelation between observed pIC50 and predicted binding energy based on the Glide scores (A), scenario 1 (B), scenario 2 and 3 (C), and modified Chelation Score (D).