On the equivalence of molecular graph convolution and molecular wave function with poor basis set.

Masashi Tsubaki Teruyasu Mizoguchi

Published in: NeurIPS (2020)

Keyphrases

dependency graph
small number
bayesian networks
directed graph
stable set
structured data
data sets
neural network
learning algorithm
probability distribution
random walk
graph theory
graph model
graph theoretic
dna computing
labeled graphs