Kernel density estimation of CSD distributions - an application to knowledge based molecular optimisation.
Patrick McCabeOliver KorbJason C. ColeRobin TaylorPublished in: J. Cheminformatics (2014)
Keyphrases
- kernel density estimation
- probability density
- density estimation
- probability density function
- density function
- mean shift
- probability distribution
- object segmentation
- random variables
- higher dimensional
- density estimates
- image processing
- gaussian mixture model
- prior knowledge
- data mining techniques
- maximum likelihood