Login / Signup
Extended study on atomic featurization in graph neural networks for molecular property prediction.
Agnieszka Wojtuch
Tomasz Danel
Sabina Podlewska
Lukasz Maziarka
Published in:
J. Cheminformatics (2023)
Keyphrases
</>
neural network
pattern recognition
three dimensional
random walk
statistical analysis
artificial neural networks
empirical studies
prediction accuracy
radial basis function
prediction model
prediction error
multi layer perceptron
prediction algorithm