Research Article

[Retracted] Two Myricetin-Derived Flavonols from Morella rubra Leaves as Potent α-Glucosidase Inhibitors and Structure-Activity Relationship Study by Computational Chemistry

Table 2

Statistical data and field contribution of 3D-QSAR models.

CoMFACoMSIA

Statistics parameters
0.5980.730
1.0000.998
 ONC147
 SEE0.0040.055
123105.1351144.174
Field contribution (%)
 Steric55.111.2
 Electrostatic44.925.5
 Hydrophobic13.0
 Hydrogen bond donor30.2
 Hydrogen bond acceptor20.1
0.9060.896

CoMFA: comparative molecular field analysis; CoMSIA: comparative similarity index analysis; : cross-validated correlation coefficient; , non-cross-validated coefficient; ONC: optimal number of components; SEE: standard error of estimation; : test value; : predictive correlation coefficient.