Proteochemometric modelling coupled to in silico target prediction: an integrated approach for the simultaneous prediction of polypharmacology and binding affinity/potency of small molecules

Author(s):: Paricharak, S.; Cortés-Ciriano, I.; IJzerman, A.P. (0000-0002-1182-2259); Malliavin, T.E.; Bender, A.

Published: 2015
Publication type: Article / Letter to editor

Date issued: 2015-04-15
Language: English
Is part of: Journal of Cheminformatics
hdl: 1887/3198557
doi: 10.1186/s13321-015-0063-9
URL: http://www.jcheminf.com/content/7/1/15