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Evaluating Scalable Uncertainty Estimation Methods for Deep Learning-Based Molecular Property Prediction.
Gabriele Scalia
Colin A. Grambow
Barbara Pernici
Yi-Pei Li
William H. Green Jr.
Published in:
J. Chem. Inf. Model. (2020)
Keyphrases
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deep learning
computer vision
deep architectures
unsupervised feature learning
decision making
denoising