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. 2013 Oct 14;35(1):151–160. doi: 10.1038/aps.2013.105

Table 2. The summary analysis of 3D-QSAR and 3D-QSSR models.

Statistical results pIC50 (CDK4) log[IC50 (CDK2)/IC50 (CDK4)]
q2a 0.724 0.742
ONCb 6 5
r2c 0.965 0.923
F valued 186.497 100.497
SEEe 0.148 0.182
r2predf Field contribution 0.945 0.863
Steric/Electrostatic 0.548/0.452 0.444/0.556

aCross-validated coefficient;

bOptimal number of components;

cConventional correlation coefficient;

dFisher test value;

eStandard error of estimate;

fPredictive correlation coefficient.