Searching Techniques for Databases of Two- and Three-Dimensional Chemical Structures
- 28 May 2005
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of Medicinal Chemistry
- Vol. 48 (13) , 4183-4199
- https://doi.org/10.1021/jm0582165
Abstract
No abstract availableKeywords
This publication has 116 references indexed in Scilit:
- A Structural Similarity Analysis of Double-helical DNAJournal of Molecular Biology, 2004
- Recognition of spatial motifs in protein structures 1 1Edited by J. ThorntonJournal of Molecular Biology, 1999
- Development and validation of a genetic algorithm for flexible docking 1 1Edited by F. E. CohenJournal of Molecular Biology, 1997
- Neighborhood Behavior: A Useful Concept for Validation of “Molecular Diversity” DescriptorsJournal of Medicinal Chemistry, 1996
- Substructure searching methods: Old and newJournal of Chemical Information and Computer Sciences, 1993
- Pharmacophoric pattern matching in files of three-dimensional chemical structures: use of bounded distance matrices for the representation and searching of conformationally flexible moleculesJournal of Molecular Graphics, 1992
- An exact algorithm for the maximum clique problemOperations Research Letters, 1990
- Pharmacophoric pattern matching in files of 3D chemical structures: evaluation of search performanceJournal of Molecular Graphics, 1987
- Pharmacophoric pattern matching in files of 3-D chemical structures: selection of interatomic distance screensJournal of Molecular Graphics, 1986
- Atom pairs as molecular features in structure-activity studies: definition and applicationsJournal of Chemical Information and Computer Sciences, 1985