Rapid Scanning Structure–Activity Relationships in Combinatorial Data Sets: Identification of Activity Switches-Reference-Cited by-同舟云学术

Rapid Scanning Structure–Activity Relationships in Combinatorial Data Sets: Identification of Activity Switches

Published:2013-06-07 Issue:6 Volume:53 Page:1475-1485
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Medina-Franco José L.¹,Edwards Bruce S.²,Pinilla Clemencia³,Appel Jon R.³,Giulianotti Marc A.¹,Santos Radleigh G.¹,Yongye Austin B.¹,Sklar Larry A.²,Houghten Richard A.¹²

Affiliation:

1. Torrey Pines Institute for Molecular Studies, Port St. Lucie, Florida 34987, United States

2. University of New Mexico, Albuquerque, New Mexico 87131, United States

3. Torrey Pines Institute for Molecular Studies, San Diego California 92121, United States

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/ci400192y

Reference33 articles.

1. Exploring Activity Cliffs in Medicinal Chemistry

2. Modeling of activity landscapes for drug discovery

3. Scanning Structure–Activity Relationships with Structure–Activity Similarity and Related Maps: From Consensus Activity Cliffs to Selectivity Switches

4. MMP-Cliffs: Systematic Identification of Activity Cliffs on the Basis of Matched Molecular Pairs

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