To estimate the “optimal” rank, cross validation is used

2005

To estimate the “optimal” rank, cross validation is used

2005

- To estimate the “optimal” rank, cross validation is used
- $ are obtained using the residuals from previous rank as a new dependent variable y. The partial least squares method is equivalent to the conjugate gradient method used in
- Jackknife estimates of the standard errors are thereby obtained with no extra computation
- Three-Dimensional Quantitative Structure−Property Relationship Models for Prediction of Thermodynamic Properties of Polychlorinated Biphenyls: Enthalpies of Fusion and Their Application to Estimates of Enthalpies of Sublimation and Aqueous Solubilities