The Relevance of Goodness‐of‐fit, Robustness and Prediction Validation Categories of OECD‐QSAR Principles with Respect to Sample Size and Model Type
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DOI: 10.1002/minf.202200072
Abstract: We investigated the relevance of the validation principles on the Quantitative Structure Activity Relationship models issued by Organization for Economic and Co‐operation and Development. We checked the goodness‐of‐fit, robustness and predictivity categories in linear and… read more here.
Keywords: fit robustness; validation; goodness fit; sample size ... See more keywords