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Chirico et al., 2011 - Google Patents

Real external predictivity of QSAR models: how to evaluate it? Comparison of different validation criteria and proposal of using the concordance correlation coefficient

Chirico et al., 2011

Document ID
18259402670176825994
Author
Chirico N
Gramatica P
Publication year
Publication venue
Journal of chemical information and modeling

External Links

Snippet

The main utility of QSAR models is their ability to predict activities/properties for new chemicals, and this external prediction ability is evaluated by means of various validation criteria. As a measure for such evaluation the OECD guidelines have proposed the …
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