Optimize

Optimize

• Hyperparameter Optimization using chemml.optimization.GeneticAlgorithm
  • Defining hyperparameter space
  • Defining objective function
  • Optimize the model
  • Resume optimization
• Feature Selection using chemml.optimization.GeneticAlgorithm
  • Defining hyperparameter space
  • Defining objective function
  • Optimize the feature space
• Active Learning
  • Keras model example
  • Initialize active learning: EMC
  • Start the active search
  • Get a baseline: random sampling
  • Visualize distributions
  • Search in a loop
  • Create a video