Exploring Activity Cliffs in Medicinal Chemistry
Author:
Affiliation:
1. Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Dahlmannstrasse 2, D-53113 Bonn, Germany
Publisher
American Chemical Society (ACS)
Subject
Drug Discovery,Molecular Medicine
Link
https://pubs.acs.org/doi/pdf/10.1021/jm201706b
Reference40 articles.
1. Navigating structure–activity landscapes
2. Systematic computational analysis of structure–activity relationships: concepts, challenges and recent advances
3. Bajorath, J.; Maggiora, G.; Lajiness, M., Organizers. The Emerging Concepts of Activity Landscapes and Activity Cliffs and Their Role in Drug Research. Section A of the Divisions of Chemical Information and Computers in Chemistry, 240th National Meeting of the American Chemical Society, Boston, MA, August 22–26, 2010.
4. Activity Landscape Representations for Structure−Activity Relationship Analysis
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