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Scalable Gaussian process regression enables accurate prediction of protein and small molecule properties with uncertainty quantitation.
Jonathan Parkinson
Wei Wang
Published in:
CoRR (2023)
Keyphrases
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gaussian process regression
physico chemical
gaussian process
contact map
subcellular localization
gaussian processes
drug discovery
covariance function
protein structure prediction
protein sequences
protein interaction
reinforcement learning
upper bound
incremental learning
physicochemical properties