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SCRAMBLE’N’GAMBLE: a tool for fast and facile generation of random data for statistical evaluation of QSAR models

A common practice in modern QSAR modelling is to derive models by variable selection methods working on large descriptor pools. As pointed out previously, this is intrinsically burdened with the risk of finding random correlations. Therefore it is desirable to perform tests showing the performance o...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Veröffentlicht in:Chem. Zvesti
Hauptverfasser: Lipiński, Piotr F. J., Szurmak, Przemysław
Format: Artigo
Sprache:Inglês
Veröffentlicht: Springer International Publishing 2017
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC5655615/
https://ncbi.nlm.nih.gov/pubmed/29104352
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s11696-017-0215-7
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