Statistical variation in progressive scrambling

The two methods most often used to evaluate the robustness and predictivity of partial least squares (PLS) models are cross-validation and response randomization. Both methods may be overly optimistic for data sets that contain redundant observations, however. The kinds of perturbation analysis wide...

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Veröffentlicht in:	Journal of computer-aided molecular design 2004-07, Vol.18 (7-9), p.563-576
Hauptverfasser:	Clark, Robert D, Fox, Peter C
Format:	Artikel
Sprache:	eng
Schlagworte:	Adjustment CAD Computer aided design Data Interpretation, Statistical Least squares method Least-Squares Analysis Mathematical models Molecular biology Perturbation methods Quantitative Structure-Activity Relationship Regression Sampling Statistics
Online-Zugang:	Volltext
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