QSAR studies antiproliferative activity of heterocyclic compounds based on 2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl).

Fatima Zahra EL Chokrafi, Fouad Khalil & Mohammed Bouachrine
A QSAR study of the antiproliferative activity is applied to a set of 22 molecules using the principal component analysis (PCA), multiple linear regression (MLR) (R = 0,754), multiple nonlinear regression (MNLR) (R = 0,981) and artificial neural network (ANN) (R = 0,987) method, and finally the model was validated with the cross-validation "leave-one-out" (CV-LOO) (R = 0,601), the values of the predicted activities are in agreement with the experimental results. From the results of...
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