Research output per year
Research output per year
Project Details
Description
Classification tools are applied to the properties of critical points (obtained by topological analysis) of electronic density map of pharmacological molecules. The results allow to establish chemical identification criteria of those critical points and are used in an original logical process of pharmacophore proposition.
| Status | Finished |
|---|---|
| Effective start/end date | 1/08/00 → 31/12/02 |
Keywords
- electron density maps
- topological analysis
- multiresolution analysis
- clustering
- logic programming
- pharmacophore propositions
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Research output
- 1 Chapter
-
Multiresolution Analysis of Topological Representations of Structural and Physico-Chemical Properties of Pharmacological Molecules
Biname, J., Leherte, L. & Vercauteren, D., 2002, Abstracts of Papers of the American Chemical Society. Vol. 223. p. CINF-005Research output: Contribution in Book/Catalog/Report/Conference proceeding › Chapter