Graph Nets for Partial Charge Prediction.

Yuanqing Wang Josh Fass Chaya D. Stern Kun Luo John D. Chodera

Published in: CoRR (2019)

Keyphrases

prediction accuracy
graph structure
directed graph
prediction model
protein function prediction
prediction error
graph theory
graph matching
structured data
graph model
dependency graph
data sets
learning algorithm
machine learning
graph theoretic
graphical representation
graph clustering
graph construction