Theoretical Scales of Hydrogen Bond Acidity and Basicity for Application in QSAR/QSPR Studies and Drug Design. Partitioning of Aliphatic Compounds-Reference-Cited by-同舟云学术

Theoretical Scales of Hydrogen Bond Acidity and Basicity for Application in QSAR/QSPR Studies and Drug Design. Partitioning of Aliphatic Compounds

Published:2004-05-01 Issue:3 Volume:44 Page:1042-1055
ISSN:0095-2338
Container-title:Journal of Chemical Information and Computer Sciences
language:en
Short-container-title:J. Chem. Inf. Comput. Sci.

Author:

Oliferenko Alexander A.¹,Oliferenko Polina V.¹,Huddleston Jonathan G.¹,Rogers Robin D.¹,Palyulin Vladimir A.¹,Zefirov Nikolai S.¹,Katritzky Alan R.¹

Affiliation:

1. Department of Chemistry, Moscow State University, Moscow, 119899 Russia, Florida Center for Heterocyclic Compounds, Department of Chemistry, University of Florida, Gainesville, Florida 32611-7200, and Department of Chemistry and Center for Green Manufacturing, The University of Alabama, Tuscaloosa, Alabama 35487

Publisher

American Chemical Society (ACS)

Subject

Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci0342932

Reference54 articles.

1. Hydrogen Bonding in Biological Structures

2. The solvatochromic comparison method. I. The .beta.-scale of solvent hydrogen-bond acceptor (HBA) basicities

3. The solvatochromic comparison method. I. The .beta.-scale of solvent hydrogen-bond acceptor (HBA) basicities

4. Linear solvation energy relationships. 23. A comprehensive collection of the solvatochromic parameters, .pi.*, .alpha., and .beta., and some methods for simplifying the generalized solvatochromic equation

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