"Learning Invariant Representations of Molecules for Atomization Energy ..."

Grégoire Montavon et al. (2012)

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type: Conference or Workshop Paper

metadata version: 2021-07-12

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Grégoire Montavon, Katja Hansen, Siamac Fazli, Matthias Rupp, Franziska Biegler, Andreas Ziehe, Alexandre Tkatchenko, O. Anatole von Lilienfeld, Klaus-Robert Müller:
Learning Invariant Representations of Molecules for Atomization Energy Prediction. NIPS 2012: 449-457

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