Development of a Method To Consistently Quantify the Structural Distance between Scaffolds and To Assess Scaffold Hopping Potential-Reference-Cited by-同舟云学术

Development of a Method To Consistently Quantify the Structural Distance between Scaffolds and To Assess Scaffold Hopping Potential

Published:2011-10-07 Issue:10 Volume:51 Page:2507-2514
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Li Ruifang¹,Stumpfe Dagmar¹,Vogt Martin¹,Geppert Hanna¹,Bajorath Jürgen¹

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

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci2003945

Reference23 articles.

1. Lessons Learned from Molecular Scaffold Analysis

2. The Properties of Known Drugs. 1. Molecular Frameworks

3. The Scaffold Tree − Visualization of the Scaffold Universe by Hierarchical Scaffold Classification

4. Algorithm for Naming Molecular Equivalence Classes Represented by Labeled Pseudographs

5. “Scaffold-Hopping” by Topological Pharmacophore Search: A Contribution to Virtual Screening

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