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» Optimal assignment kernels for attributed molecular graphs
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ICML
2005
IEEE
14 years 5 months ago
Optimal assignment kernels for attributed molecular graphs
We propose a new kernel function for attributed molecular graphs, which is based on the idea of computing an optimal assignment from the atoms of one molecule to those of another ...
Andreas Zell, Florian Sieker, Holger Fröhlich...
ACIVS
2009
Springer
13 years 11 months ago
Attributed Graph Matching Using Local Descriptions
Abstract. In the pattern recognition context, objects can be represented as graphs with attributed nodes and edges involving their relations. Consequently, matching attributed grap...
Salim Jouili, Ines Mili, Salvatore Tabbone
BMCBI
2011
12 years 11 months ago
Hierarchical graphs for rule-based modeling of biochemical systems
Background: In rule-based modeling, graphs are used to represent molecules: a colored vertex represents a component of a molecule, a vertex attribute represents the internal state...
Nathan W. Lemons, Bin Hu, William S. Hlavacek
BIBE
2006
IEEE
154views Bioinformatics» more  BIBE 2006»
13 years 11 months ago
Determining Molecular Similarity for Drug Discovery using the Wavelet Riemannian Metric
Discerning the similarity between two molecules is a challenging problem in drug discovery as well as in molecular biology. The importance of this problem is due to the fact that ...
Elinor Velasquez, Emmanuel R. Yera, Rahul Singh
AAIM
2009
Springer
101views Algorithms» more  AAIM 2009»
13 years 11 months ago
Three Results on Frequency Assignment in Linear Cellular Networks
In the frequency assignment problem we are given a graph representing a wireless network and a sequence of requests, where each request is associated with a vertex. Each request h...
Marek Chrobak, Jiri Sgall