"Lead Optimization Using Matched Molecular Pairs: Inclusion of Contextual ..."

George Papadatos et al. (2010)

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DOI: 10.1021/CI100258P

access: closed

type: Journal Article

metadata version: 2020-03-06

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George Papadatos, Muhammad Alkarouri, Valerie J. Gillet, Peter Willett, Visakan Kadirkamanathan, Christopher N. Luscombe, Gianpaolo Bravi, Nicola J. Richmond, Stephen D. Pickett, Jameed Hussain, John Pritchard, Anthony W. J. Cooper, Simon J. F. Macdonald:
Lead Optimization Using Matched Molecular Pairs: Inclusion of Contextual Information for Enhanced Prediction of hERG Inhibition, Solubility, and Lipophilicity. J. Chem. Inf. Model. 50(10): 1872-1886 (2010)

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