Description Usage Arguments Details Value References See Also
Validation the model through test set by the external squared-Q
1 | Qsquared.ext(y.pre, y, ytr)
|
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 |
The value of squared Q should be greater than or eaqual than 0.5.
Qsquared.ext |
It is a numeric value and it should be greater than 0.5 in a successful QSAR model. |
A. Tropsha, P. Gramatica, V. K. Gombar, QSAR Comb. Sci. 2003, 22, 69-77
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