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MLRMPA (version 1.0)
Qsquared.ext: Squared-Q of the Test Set
Description
Validation the model through test set by the external squared-Q
Usage
Qsquared.ext(y.pre, y, ytr)
Arguments
y.pre
calculated response values of test set
y
observed values of test set, a 1*(n-m) dataframe (n-m is the sample number of test set)
ytr
the response variable of the training set, a 1*m dataframe
Value
Qsquared.ext
It is a numeric value and it should be greater than 0.5 in a successful QSAR model.
Details
The value of squared Q should be greater than or eaqual than 0.5.
References
A. Tropsha, P. Gramatica, V. K. Gombar,
QSAR Comb. Sci.
2003
,
22
, 69-77
See Also
Rsquared