Benchmarking the Predictive Power of Ligand Efficiency Indices in QSAR-Reference-Cited by-同舟云学术

Benchmarking the Predictive Power of Ligand Efficiency Indices in QSAR

Published:2016-07-19 Issue:8 Volume:56 Page:1576-1587
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Cortes-Ciriano Isidro¹

Affiliation:

1. Département de Biologie Structurale et Chimie, Institut Pasteur, Unité de Bioinformatique Structurale, CNRS UMR 3825, 25, rue du Dr Roux, 75015 Paris, France

Funder

Institut Pasteur

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/acs.jcim.6b00136

Reference56 articles.

1. Probing the links between in vitro potency, ADMET and physicochemical parameters

2. An Analysis of the Binding Efficiencies of Drugs and Their Leads in Successful Drug Discovery Programs

3. The role of ligand efficiency metrics in drug discovery

4. Ligand Binding Efficiency: Trends, Physical Basis, and Implications

5. Ligand efficiency: a useful metric for lead selection

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