Machine Learning Estimates of Natural Product Conformational Energies.
Matthias RuppMatthias R. BauerRainer WilckenAndreas LangeMichael ReutlingerFrank M. BoecklerGisbert SchneiderPublished in: PLoS Comput. Biol. (2014)
Keyphrases
- machine learning
- machine learning algorithms
- real world
- learning algorithm
- computer vision
- decision trees
- knowledge engineering
- markov random field
- higher order
- supervised learning
- learning tasks
- model selection
- learning systems
- text classification
- natural language processing
- machine learning methods
- computer science
- natural language
- pattern recognition
- machine learning approaches
- coarse grained
- learning problems
- transfer learning
- product design
- semi supervised learning
- knowledge acquisition
- text mining
- information extraction
- active learning
- data analysis
- reinforcement learning
- case study
- artificial intelligence
- genetic algorithm