ChemVA: Interactive Visual Analysis of Chemical Compound Similarity in Virtual Screening.
María Virginia SabandoPavol UlbrichMatias Nicolás SelzerJan ByskaJan MicanIgnacio PonzoniAxel J. SotoMaria Luján GanuzaBarbora KozlíkováPublished in: IEEE Trans. Vis. Comput. Graph. (2021)
Keyphrases
- visual analysis
- virtual screening
- drug discovery
- levenshtein distance
- visual analytics
- interactive exploration
- chemical structures
- information visualization
- similarity searching
- binding sites
- scoring function
- data visualization
- similarity measure
- high throughput
- chemical compounds
- similarity search
- scientific data
- distance function
- early stage
- microarray
- data analysis
- data mining
- database
- discovery process
- knowledge discovery