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From Molecules to Materials: Pre-training Large Generalizable Models for Atomic Property Prediction.
Nima Shoghi
Adeesh Kolluru
John R. Kitchin
Zachary W. Ulissi
C. Lawrence Zitnick
Brandon M. Wood
Published in:
CoRR (2023)
Keyphrases
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statistical models
prediction model
bayesian networks
model selection
statistical model
training algorithm
training set
machine learning algorithms
regression model
classification models