Substructure Mining Using Elaborate Chemical Representation-Reference-Cited by-同舟云学术

Substructure Mining Using Elaborate Chemical Representation

Published:2006-01-19 Issue:2 Volume:46 Page:597-605
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Kazius Jeroen¹,Nijssen Siegfried¹,Kok Joost¹,Bäck Thomas¹,IJzerman Adriaan P.¹

Affiliation:

1. Division of Medicinal Chemistry, Leiden-Amsterdam Center for Drug Research, Leiden University, P.O. Box 9502, Einsteinweg 55, 2300 RA Leiden, The Netherlands, and Algorithms Cluster, Leiden Institute of Advanced Computer Science, Leiden University, Niels Bohrweg 1, 2333 CA Leiden, The Netherlands

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/ci0503715

Reference46 articles.

1. Toward the Design of Chemical Libraries for Mass Screening Biased against Mutagenic Compounds

2. Data Mining and Machine Learning Techniques for the Identification of Mutagenicity Inducing Substructures and Structure Activity Relationships of Noncongeneric Compounds

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