Features Reweighting and Selection in ligand-based Virtual Screening for Molecular Similarity Searching Based on Deep Belief Networks.
Maged NasserNaomie SalimHamza HentabliFaisal SaeedIdris RabiuPublished in: Adv. Data Sci. Adapt. Anal. (2020)
Keyphrases
- virtual screening
- similarity searching
- chemical structures
- drug discovery
- similarity search
- metric space
- search tools
- multimedia databases
- feature extraction
- binding sites
- high throughput
- deep belief networks
- early stage
- feature vectors
- feature space
- scoring function
- indexing techniques
- knn
- chemical compounds
- data mining