Multiple Structures for Virtual Ligand Screening: Defining Binding Site Properties-Based Criteria to Optimize the Selection of the Query-Reference-Cited by-同舟云学术

Multiple Structures for Virtual Ligand Screening: Defining Binding Site Properties-Based Criteria to Optimize the Selection of the Query

Published:2013-01-29 Issue:2 Volume:53 Page:293-311
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Ben Nasr Nesrine¹,Guillemain Hélène¹,Lagarde Nathalie¹,Zagury Jean-François¹,Montes Matthieu¹

Affiliation:

1. Laboratoire Génomique Bioinformatique et Applications, Équipe d’accueil EA 4627, Conservatoire National des Arts et Métiers, 292 rue Saint Martin, 75003 Paris, 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/ci3004557

Reference41 articles.

1. High-throughput docking as a source of novel drug leads

2. Use of an Induced Fit Receptor Structure in Virtual Screening

3. Protein Flexibility in Ligand Docking and Virtual Screening to Protein Kinases

4. Unveiling the Full Potential of Flexible Receptor Docking Using Multiple Crystallographic Structures

5. Ensemble Docking into Multiple Crystallographically Derived Protein Structures: An Evaluation Based on the Statistical Analysis of Enrichments

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