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Alignment of three-dimensional molecules using an image recognition algorithm

Published:2004-10 Issue:2 Volume:23 Page:199-209
ISSN:1093-3263
Container-title:Journal of Molecular Graphics and Modelling
language:en
Short-container-title:Journal of Molecular Graphics and Modelling

Author:

Richmond Nicola J.,Willett Peter,Clark Robert D.

Publisher

Elsevier BV

Subject

Materials Chemistry,Computer Graphics and Computer-Aided Design,Physical and Theoretical Chemistry,Spectroscopy

Reference19 articles.

1. Computational methods for the structural alignment of molecules;Lemmen;J. Comput. Aid. Mol. Des,2000

2. Novel alignment method of small molecules using the Hopfield Neural Network;Arakawa;J. Chem. Inf. Comput. Sci,2003

3. Field interaction and geometrical overlap: a new simplex and experimental design based computational procedure for superposing small ligand molecules;Melani;J. Med. Chem,2003

4. R.E. Burkard, E. Dragoti-Çela, Linear assignment problems and extensions, in: Z. Du, P. Pardalos (Eds.), Handbook of Combinatorial Optimization I, Kluwer Academic Publishers, Dordrecht, 1999, pp. 75–149.

5. A shortest augmenting path algorithm for dense and sparse linear assignment problems;Jonker;Computing,1987

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