The Local Minima Method (LMM) of Pharmacophore Determination: A Protocol for Predicting the Bioactive Conformation of Small, Conformationally Flexible Molecules-Reference-Cited by-同舟云学术

The Local Minima Method (LMM) of Pharmacophore Determination: A Protocol for Predicting the Bioactive Conformation of Small, Conformationally Flexible Molecules

Published:1998-10-24 Issue:6 Volume:38 Page:1125-1136
ISSN:0095-2338
Container-title:Journal of Chemical Information and Computer Sciences
language:en
Short-container-title:J. Chem. Inf. Comput. Sci.

Author:

Demeter David A.¹,Weintraub Herschel J. R.¹,Knittel James J.¹

Affiliation:

1. The R.W. Johnson Pharmaceutical Research Institute, Route 202, P.O. Box 300, Raritan, New Jersey 08869, Helios Pharmaceuticals, Inc., 9800 Bluegrass Pkwy, Louisville, Kentucky 40299, and University of Cincinnati, Division of Pharmaceutical Sciences, College of Pharmacy, Cincinnati, Ohio 45267-0004

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/ci980404z

Reference76 articles.

1. Demeter, D. A. Development and Application of Potential Energy Surface Analysis and the Local Minima Method of Pharmacophore Determination. Ph.D. Dissertation, University of Cincinnati, 1994; pp 1−179.

2. (a) Villafranca, J. J.; Ash, D. E.; Colombo, G.; Fitzpatrick, P. F.; Papadopoulos, N. J.; Rajashekhar, B.Molecular Architecture of Proteins and Enzymes; Bradshaw, R. A., Tang, J., Eds.; Academic Press: Orlando, FL, 1985; pp 31−50.

3. DOPAMINE BETA-HYDROXYLASE OF ADRENAL CHROMAFFIN GRANULES: STRUCTURE AND FUNCTION

4. Evidence for two copper atoms/subunit in dopamine beta-monooxygenase catalysis.

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