Towards agile large-scale predictive modelling in drug discovery with flow-based programming design principles.
Samuel LampaJonathan AlvarssonOla SpjuthPublished in: J. Cheminformatics (2016)
Keyphrases
- design principles
- drug discovery
- software engineering
- pharmaceutical industry
- chemical compounds
- virtual screening
- design process
- design patterns
- software development
- user interface
- scientific data
- early stage
- data mining
- systems biology
- real world
- machine learning
- artificial intelligence
- knowledge discovery
- biological systems
- data mining tools
- knowledge base
- discovery process
- databases
- data mining techniques
- object oriented