Virtual Computational Chemistry Laboratory

Input data Output results Example List of key words



VALIDATION

Keyword of Binary Type

This keyword indicates which data entries will be used as the validation data set, i.e. the set that is used to monitor neural network training procedure. This keyword must be used together with validation option of PARTITION keyword.

Notice, that option AVOID and INCLUDE are related to the selection of input variables (columns), while this option is used to select the data entries (rows in the data table).

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