OpenFEPOPS: A Python implementation of the FEPOPS molecular similarity technique
Author:
Publisher
The Open Journal
Subject
General Earth and Planetary Sciences,General Environmental Science
Link
https://joss.theoj.org/papers/10.21105/joss.05763.pdf
Reference15 articles.
1. Flexible 3D pharmacophores as descriptors of dynamic biological space;Nettles;Journal of Molecular Graphics and Modelling,2007
2. A 3D similarity method for scaffold hopping from known drugs or natural ligands to new chemotypes;Jenkins;Journal of medicinal chemistry,2004
3. Feature point pharmacophores (FEPOPS);Jenkins;Scaffold hopping in medicinal chemistry,2013
4. State-of-the-art in ligand-based virtual screening;Ripphausen;Drug discovery today,2011
5. Principles of early drug discovery;Hughes;British journal of pharmacology,2011
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