Merits and pitfalls of conventional and covalent docking in identifying new hydroxyl aryl aldehyde like compounds as human IRE1 inhibitors

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Authors: Antonio Carlesso, Chetan Chintha, Adrienne M. Gorman, Afshin Samali, Leif A. Eriksson

Journal title: Scientific Reports

Journal number: 9/1

Journal publisher: Nature Publishing Group

Published year: 2019

DOI identifier: 10.1038/s41598-019-39939-z

ISSN: 2045-2322