Molecular Graph Augmentation with Rings and Functional Groups.
Kurt De GraveFabrizio CostaPublished in: J. Chem. Inf. Model. (2010)
Keyphrases
- protein function prediction
- random walk
- graph theoretic
- graph theory
- graph representation
- communities in social networks
- directed graph
- graph structure
- graph model
- dependency graph
- graph databases
- search engine
- weighted graph
- structured data
- directed acyclic graph
- group members
- cluster analysis
- van der waals
- undirected graph
- graph matching
- random graphs
- connected components
- densely connected