Clustering and Classifying Diverse HIV Entry Inhibitors Using a Novel Consensus Shape-Based Virtual Screening Approach: Further Evidence for Multiple Binding Sites within the CCR5 Extracellular Pocket.
Violeta I. Pérez-NuenoDavid W. RitchieJosé I. BorrellJordi TeixidóPublished in: J. Chem. Inf. Model. (2008)
Keyphrases
- binding sites
- virtual screening
- drug discovery
- transcription factors
- dna sequences
- sequence data
- gene expression
- clustering algorithm
- biological sequences
- statistical significance
- dna binding
- human immunodeficiency virus
- k means
- similarity searching
- consensus clustering
- cluster analysis
- cluster ensemble
- amino acids
- feature selection