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A Systematic Comparison Study on Hyperparameter Optimisation of Graph Neural Networks for Molecular Property Prediction.
Yingfang Yuan
Wenjun Wang
Wei Pang
Published in:
CoRR (2021)
Keyphrases
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neural network
genetic algorithm
pattern recognition
statistical analysis
social networks
empirical studies
three dimensional
prediction accuracy
connected components
qualitative and quantitative
graph theory
graph representation
prediction algorithm
neural network ensemble