Novel 3D Descriptors Using Excluded Volume 2: Application to Drug Classification
- 2 October 1998
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of Chemical Information and Computer Sciences
- Vol. 38 (6) , 1157-1160
- https://doi.org/10.1021/ci980208s
Abstract
No abstract availableKeywords
This publication has 8 references indexed in Scilit:
- Data structure comparison using fractal analysisChemometrics and Intelligent Laboratory Systems, 1997
- Neighborhood Behavior: A Useful Concept for Validation of “Molecular Diversity” DescriptorsJournal of Medicinal Chemistry, 1996
- Three-Dimensional Quantitative Structure-Activity Relationship (QSAR) of HIV Integrase Inhibitors: A Comparative Molecular Field Analysis (CoMFA) StudyJournal of Medicinal Chemistry, 1995
- Understanding and using genetic algorithms Part 2. Representation, configuration and hybridizationChemometrics and Intelligent Laboratory Systems, 1994
- 3D-QSAR of angiotensin-converting enzyme and thermolysin inhibitors: a comparison of CoMFA models based on deduced and experimentally determined active site geometriesJournal of the American Chemical Society, 1993
- Voronoi diagrams—a survey of a fundamental geometric data structureACM Computing Surveys, 1991
- Multivariate quantitative structure-activity relationships (QSAR): conditions for their applicabilityJournal of Chemical Information and Computer Sciences, 1983
- N,N'-(phenylene)dioxamic acids and their esters as antiallergy agentsJournal of Medicinal Chemistry, 1978