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Table 1 Comparison of DOPE score, quality factor determination through ERRAT and stereochemical property generated by Ramachandran plot of five models predicted through MODELLER

From: In-silico screening of Schistosoma mansoni Sirtuin1 inhibitors for prioritization of drug candidates

  Residues in most favored regions Residues in additional allowed region Residues in generously allowed region Residue in disallowed region DOPE Score Overall quality score errat
Model1 0.858 0.125 0.009 0.009 −43,519.9 53.971
Model2 0.906 0.083 0.009 0.002 −44,363.7 60.000
Model3 0.875 0.112 0.009 0.004 −43,488.5 48.381
Model4 0.877 0.116 0.004 0.002 −43,591.1 56.883
Model5 0.891 0.096 0.011 0.002 −43,627 55.052