Fragment-guided approach to incorporating structural information into a CoMFA study: BACE-1 as an example.
Lívia Barros SalumNapoleão Fonseca ValadaresPublished in: J. Comput. Aided Mol. Des. (2010)
Keyphrases
- structural information
- structural similarity
- structural features
- empirical studies
- databases
- artificial intelligence
- database
- experimental study
- statistical analysis
- topological information
- linguistic information
- theoretical framework
- semantic information
- natural language processing
- domain knowledge
- information technology
- information systems
- data sets