Prediction of Ligand−Receptor Binding Thermodynamics by Free Energy Force Field Three-Dimensional Quantitative Structure−Activity Relationship Analysis: Applications to a Set of Glucose Analogue Inhibitors of Glycogen Phosphorylase-Reference-Cited by-同舟云学术

Prediction of Ligand−Receptor Binding Thermodynamics by Free Energy Force Field Three-Dimensional Quantitative Structure−Activity Relationship Analysis: Applications to a Set of Glucose Analogue Inhibitors of Glycogen Phosphorylase

Published:1999-06-01 Issue:12 Volume:42 Page:2169-2179
ISSN:0022-2623
Container-title:Journal of Medicinal Chemistry
language:en
Short-container-title:J. Med. Chem.

Author:

Venkatarangan Prabha¹,Hopfinger Anton J.¹

Affiliation:

1. Laboratory of Molecular Modeling and Design (M/C-781), College of Pharmacy, University of Illinois at Chicago, 833 South Wood Street, Chicago, Illinois 60612-7231

Publisher

American Chemical Society (ACS)

Subject

Drug Discovery,Molecular Medicine

Link

https://pubs.acs.org/doi/pdf/10.1021/jm980515p

Reference29 articles.

1. Hopfinger, A. J.; Burke, B. J. InConcepts and Applications of MolecularSimilarity; Johnson, M. A., Maggiora, G. M., Eds.; Wiley: New York, 1990; p 173.

2. Hopfinger, A. J.; Nakata, Y.; Max, N. InIntermolecular Forces; Pullman, B., Ed.; Reidel-Dordrecht: The Netherlands, 1981; p 431.

3. A priori prediction of activity for HIV-1 protease inhibitors employing energy minimization in the active site

4. Prediction of Drug Binding Affinities by Comparative Binding Energy Analysis

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