A deep learning approach for the blind logP prediction in SAMPL6 challenge.

Samarjeet Prasad Bernard R. Brooks

Published in: J. Comput. Aided Mol. Des. (2020)

Keyphrases

deep learning
unsupervised learning
unsupervised feature learning
machine learning
deep architectures
restricted boltzmann machine
mental models
weakly supervised
semi supervised
dimensionality reduction
decision support