Molecular similarity: The introduction of flexible fitting
- 1 September 1990
- journal article
- research article
- Published by Springer Science and Business Media LLC in Journal of Computer-Aided Molecular Design
- Vol. 4 (3), 231-238
- https://doi.org/10.1007/bf00125012
Abstract
No abstract availableKeywords
This publication has 7 references indexed in Scilit:
- Optimization of parameters for semiempirical methods I. MethodJournal of Computational Chemistry, 1989
- Molecular similarity based on electrostatic potential and electric fieldInternational Journal of Quantum Chemistry, 1987
- Development and use of quantum mechanical molecular models. 76. AM1: a new general purpose quantum mechanical molecular modelJournal of the American Chemical Society, 1985
- Studies on antidiabetic agents. I. Synthesis of 5-(4-(2-methyl-2-phenylpropoxy)-benzyl)thiazolidine-2,4-dione (AL-321) and related compounds.CHEMICAL & PHARMACEUTICAL BULLETIN, 1982
- How similar is a molecule to another? An electron density measure of similarity between two molecular structuresInternational Journal of Quantum Chemistry, 1980
- A Simplex Method for Function MinimizationThe Computer Journal, 1965
- Electronic Population Analysis on LCAO–MO Molecular Wave Functions. IThe Journal of Chemical Physics, 1955