Combining SchNet and SHARC: The SchNarc machine learning approach for excited-state dynamics.
Julia WestermayrMichael GasteggerPhilipp MarquetandPublished in: CoRR (2020)
Keyphrases
- machine learning
- machine learning approaches
- data mining
- text mining
- machine learning methods
- pattern recognition
- artificial intelligence
- training data
- expert systems
- active learning
- computational biology
- inductive learning
- learning tasks
- data sets
- machine learning algorithms
- computational intelligence
- initial conditions
- natural language processing
- knowledge representation
- multiresolution
- multiscale
- decision trees
- image processing
- social networks
- learning algorithm