Quantum Machine Learning Algorithms for Drug Discovery Applications.
Kushal BatraKimberley M. ZornDaniel H. FoilEni MineraliVictor O. GawriljukThomas R. LaneSean EkinsPublished in: J. Chem. Inf. Model. (2021)
Keyphrases
- machine learning algorithms
- drug discovery
- benchmark data sets
- learning algorithm
- machine learning
- chemical compounds
- decision trees
- learning problems
- pharmaceutical industry
- early stage
- machine learning methods
- virtual screening
- scientific data
- biological systems
- systems biology
- machine learning approaches
- data mining
- machine learning models
- data sets
- transfer learning
- discovery process
- high dimensional
- information retrieval