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Prediction of chemical reaction yields using deep learning.
Philippe Schwaller
Alain C. Vaucher
Teodoro Laino
Jean-Louis Reymond
Published in:
Mach. Learn. Sci. Technol. (2021)
Keyphrases
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deep learning
chemical reaction
unsupervised learning
machine learning
unsupervised feature learning
weakly supervised
restricted boltzmann machine
deep architectures
object detection