A constrained molecular graph generation with imposed and forbidden fragments.
Mohamed Amine OmraniWady NaanaaPublished in: SETN (2016)
Keyphrases
- graph representation
- graph theory
- graph structure
- stable set
- random walk
- bipartite graph
- graph model
- graph theoretic
- graph based algorithm
- three dimensional
- directed graph
- directed acyclic graph
- graph mining
- molecular structure
- neural network
- protein function prediction
- dependency graph
- minimum spanning tree
- graph partitioning
- spanning tree
- data mining