Pharmacophore mapping-based virtual screening followed by molecular docking studies in search of potential acetylcholinesterase inhibitors as anti-Alzheimer's agents.
Pravin AmbureSupratik KarKunal RoyPublished in: Biosyst. (2014)
Keyphrases
- knn
- virtual screening
- drug discovery
- similarity searching
- similarity search
- chemical structures
- binding sites
- multi agent
- metric space
- search tools
- multi agent systems
- hiv protease
- dna sequences
- systems biology
- early stage
- sequence data
- scoring function
- statistical significance
- metadata
- multimedia data
- similarity measure