A 3D-QSAR model for cannabinoid receptor (CB2) ligands derived from aligned pharmacophors.
Robert GüntherWinnie Deuther-ConradRares MoldovanSteffen FischerPeter BrustPublished in: J. Cheminformatics (2013)
Keyphrases
- computational model
- similarity measure
- multiscale
- mathematical model
- data mining
- knowledge discovery
- statistical methods
- conceptual model
- closed form
- hierarchical structure
- experimental data
- statistical model
- theoretical framework
- management system
- cost function
- control system
- data model
- prior knowledge
- high level
- case study
- information retrieval
- machine learning