Outliers in SAR and QSAR: Is unusual binding mode a possible source of outliers?-Reference-Cited by-同舟云学术

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Outliers in SAR and QSAR: Is unusual binding mode a possible source of outliers?

Published:2007-03-03 Issue:1-3 Volume:21 Page:63-86
ISSN:0920-654X
Container-title:Journal of Computer-Aided Molecular Design
language:en
Short-container-title:J Comput Aided Mol Des

Author:

Kim Ki Hwan

Publisher

Springer Science and Business Media LLC

Subject

Physical and Theoretical Chemistry,Computer Science Applications,Drug Discovery

Link

http://link.springer.com/content/pdf/10.1007/s10822-007-9106-2.pdf

Reference60 articles.

1. Kurup A (2003) J Comput Aided Mol Des 17:187–196

2. BioByte 201 W. 4th St., #204, Claremont, CA 91711-4707. clogp@biobyte.com. 909-624-5992

3. Berman HM, Westbrook J, Feng Z, Weissig H, Shindyalov IN, Bourne PE (2000) Nucleic Acids Res 28:235–242

4. CCDC Relibase (version 1.3.2, August 2005), Cambridge Crystallographic Data Center, 12 Union Road, Cambridge CB2 1EZ, United Kingdom

5. Thompson J, Jeanmougin F (2003) ClustalW multiple sequence alignment program (Version 1.83, June 2003)

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1. Outliers in SAR and QSAR: 4. effects of allosteric protein–ligand interactions on the classical quantitative structure–activity relationships;Molecular Diversity;2022-02-22

2. Determination of Ligand Binding Modes in Hydrated Viral Ion Channels to Foster Drug Design and Repositioning;Journal of Chemical Information and Modeling;2021-07-27

3. Outliers in SAR and QSAR: 3. Importance of considering the role of water molecules in protein–ligand interactions and quantitative structure–activity relationship studies;Journal of Computer-Aided Molecular Design;2021-03

4. Chemical Graph Theory for Property Modeling in QSAR and QSPR—Charming QSAR & QSPR;Mathematics;2020-12-29

5. How medicinal chemists learned about log P;Journal of Computer-Aided Molecular Design;2018-07-17

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