A fast and efficient method for 2D and 3D molecular shape description
- 1 December 1992
- journal article
- Published by Springer Nature in Journal of Computer-Aided Molecular Design
- Vol. 6 (6) , 607-628
- https://doi.org/10.1007/bf00126218
Abstract
No abstract availableKeywords
This publication has 50 references indexed in Scilit:
- General formulas for the Wiener IndexJournal of Chemical Information and Computer Sciences, 1991
- Clustering a large number of compounds. 3. The limits of classificationJournal of Chemical Information and Computer Sciences, 1991
- Clustering a large number of compounds. 2. Using the connection machineJournal of Chemical Information and Computer Sciences, 1991
- On using the adjacency matrix power method for perception of symmetry and for isomorphism testing of highly intricate graphsJournal of Chemical Information and Computer Sciences, 1991
- The search for functional correspondences in molecular structure between two dissimilar moleculesJournal of Theoretical Biology, 1985
- Atom pairs as molecular features in structure-activity studies: definition and applicationsJournal of Chemical Information and Computer Sciences, 1985
- Computer-assisted examination of compounds for common three-dimensional substructuresJournal of Chemical Information and Computer Sciences, 1983
- Optimization by Simulated AnnealingScience, 1983
- A geometric approach to macromolecule-ligand interactionsJournal of Molecular Biology, 1982
- Structural Determination of Paraffin Boiling PointsJournal of the American Chemical Society, 1947