Scaffold Embeddings: Learning the Structure Spanned by Chemical Fragments, Scaffolds and Compounds.

Austin Clyde Arvind Ramanathan Rick Stevens

Published in: CoRR (2021)

Keyphrases

learning algorithm
learning systems
neural network
background knowledge
euclidean space
active learning
hidden variables
technology enhanced learning
drug discovery
learning process
supervised learning
experimental data
learning tasks
learning problems
learning analytics
learning community