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The problem of overfitting.
Hawkins DM. Hawkins DM. J Chem Inf Comput Sci. 2004 Jan-Feb;44(1):1-12. doi: 10.1021/ci0342472. J Chem Inf Comput Sci. 2004. PMID: 14741005 No abstract available.
Assessing model fit by cross-validation.
Hawkins DM, Basak SC, Mills D. Hawkins DM, et al. J Chem Inf Comput Sci. 2003 Mar-Apr;43(2):579-86. doi: 10.1021/ci025626i. J Chem Inf Comput Sci. 2003. PMID: 12653524
QSAR with few compounds and many features.
Hawkins DM, Basak SC, Shi X. Hawkins DM, et al. J Chem Inf Comput Sci. 2001 May-Jun;41(3):663-70. doi: 10.1021/ci0001177. J Chem Inf Comput Sci. 2001. PMID: 11410044
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