Healthy skepticism: assessing realistic model performance
Author:
Publisher
Elsevier BV
Subject
Drug Discovery,Pharmacology
Reference16 articles.
1. Modelling as a discipline;Silvert;Int. J. Gen. Syst.,2001
2. In silico ADME/Tox: why models fail;Stouch;J. Comput. Aid. Mol. Des.,2003
3. On the probable error of a coefficient of correlation deduced from a small sample;Fisher;Metron,1921
4. PLASS: protein–ligand affinity statistical score – a knowledge-based force-field model of interaction derived from the PDB;Ozrin;J. Comput. Aid. Mol. Des.,2004
5. Estimation of hERG inhibition of drug candidates using multivariate property and pharmacophore SAR;Johnson;Bioorg. Med. Chem.,2007
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