Chronic Rat Toxicity Prediction of Chemical Compounds Using Kernel Machines.
Georg HinselmannAndreas JahnNikolas FechnerAndreas ZellPublished in: EvoBIO (2009)
Keyphrases
- chemical compounds
- kernel machines
- graph kernels
- support vector
- drug discovery
- structural features
- semi supervised
- kernel function
- graph data
- semi supervised learning
- biological networks
- graph databases
- learning machines
- learning problems
- kernel methods
- learning scheme
- learning algorithm
- multi task
- multiple kernel learning
- learning tasks
- structured data
- subgraph isomorphism
- training data