Privileged Structural Motif Detection and Analysis Using Generative Topographic Maps-Reference-Cited by-同舟云学术

Privileged Structural Motif Detection and Analysis Using Generative Topographic Maps

Published:2017-04-21 Issue:5 Volume:57 Page:1218-1232
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Kayastha Shilva¹²,Horvath Dragos²^ORCID,Gilberg Erik¹³,Gütschow Michael³,Bajorath Jürgen¹^ORCID,Varnek Alexandre²^ORCID

Affiliation:

1. Department of Life Science Informatics, B-IT, LIMES Program Unit Chemical Biology and Medicinal Chemistry, Rheinische Friedrich-Wilhelms-Universität, Dahlmannstr. 2, D-53113 Bonn, Germany

2. Laboratoire de Chemoinformatique, UMR 7140, Université de Strasbourg, 1 rue Blaise Pascal, Strasbourg 67000, France

3. Pharmaceutical Institute, University of Bonn, An der Immenburg 4, 53121 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/acs.jcim.7b00128

Reference50 articles.

1. Methods for drug discovery: development of potent, selective, orally effective cholecystokinin antagonists

2. Chemical Space Mapping and Structure–Activity Analysis of the ChEMBL Antiviral Compound Set

3. Data Mining with Decision Trees

4. Analysis of a Large Structure/Biological Activity Data Set Using Recursive Partitioning

5. Analysis of a 29 Full Factorial Chemical Library

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