Machine Learning Directed Optimization of Classical Molecular Modeling Force Fields.
Bridgette J. BefortRyan S. DeFeverGarrett M. TowAlexander W. DowlingEdward J. MaginnPublished in: J. Chem. Inf. Model. (2021)
Keyphrases
- machine learning
- optimization algorithm
- optimization approaches
- computer vision
- decision trees
- machine learning approaches
- optimization process
- learning tasks
- optimization method
- genetic algorithm
- optimization problems
- computational intelligence
- natural language processing
- knowledge representation
- computer science
- feature selection
- text classification
- knowledge acquisition
- supervised learning
- natural language
- three dimensional
- modeling method
- data driven approaches