Skip to main content
. 2016 Spring;15(2):425–437.

Table 4.

The results of QSAR analysis by MLRa and GA-PLSb methods for the compounds in series 1-7

Cell line Method R 2 c Q 2 d SE pred e R 2 pred f
L1210 MLR 0.70 0.50 0.44 0.69
PLS 0.86 0.66 0.37 0.81
CEM MLR 0.85 0.77 0.29 0.81
PLS 0.87 0.71 0.35 0.83
Molt4/C8 MLR 0.81 0.72 0.34 0.64
PLS 0.91 0.77 0.32 0.82
a)

Multiple linear regressions,

b)

Genetic algorithm-partial least square,

c)

correlation coefficient of regression,

d)

Leave-one-out cross-validation correlation coefficient (R2CV),

e)

Standard error of prediction regression,

f)

Correlation coefficient of prediction regression