Feature selection method reducing correlations among features by embedding domain knowledge

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Natural Sciences, Evolutionary Biology, Algorithms +10

Detecting Novel Associations in Large Data Sets

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Natural Sciences, Biostatistics, Data Science +8

Crystal Graph Convolutional Neural Networks for an Accurate and Interpretable Prediction of Material Properties

Tian Xie, Jeffrey C. Grossman · Physical Review Letters · 2018 · 2.6K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +17

Recent advances and applications of machine learning in solid-state materials science

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Natural Sciences, Materials Engineering, Materials Science +11

A general-purpose machine learning framework for predicting properties of inorganic materials

Logan Ward, Ankit Agrawal, Alok Choudhary et al. · npj Computational Materials · 2016 · 1.7K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +16