Assessing the Geometric Diversity of Cytochrome P450 Ligand Conformers by Hierarchical Clustering with a Stop Criterion
Author:
Affiliation:
1. CEA/DSV/iBiTec-S/SB2SM (CNRS URA 2096), 91191 Gif-sur-Yvette, France, and UFR de Chimie, Université Louis Pasteur, 67008 Strasbourg Cedex, France
Publisher
American Chemical Society (ACS)
Subject
Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci800275k
Reference38 articles.
1. Improvement of Cyclophosphamide Activation by CYP2B6 Mutants: From in Silico to ex Vivo
2. Unusual Regioselectivity and Active Site Topology of Human Cytochrome P450 2J2
3. Ligand-Based Models for the Isoform Specificity of Cytochrome P450 3A4, 2D6, and 2C9 Substrates
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