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Ksenia Briling

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https://people.epfl.ch/ksenia.briling

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Ksenia Briling

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Integer Linear Programming for Unsupervised Training Set Selection in Molecular Machine Learning

Benchmarking machine-readable vectors of chemical reactions on computed activation barriers

Encoding quantum-chemical knowledge into machine-learning models of complex molecular properties

Integer Linear Programming for Unsupervised Training Set Selection in Molecular Machine Learning

Benchmarking machine-readable vectors of chemical reactions on computed activation barriers

Encoding quantum-chemical knowledge into machine-learning models of complex molecular properties