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Genetic Optimization of Training Sets for Improved Machine Learning Models of Molecular Properties

Type of publication Peer-reviewed
Publikationsform Original article (peer-reviewed)
Author Browning Nicholas J., Ramakrishnan Raghunathan, von Lilienfeld O. Anatole, Roethlisberger Ursula,
Project Multiscale Simulations for Biological Signaling and Biomimetic Design
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Original article (peer-reviewed)

Journal The Journal of Physical Chemistry Letters
Volume (Issue) 8(7)
Page(s) 1351 - 1359
Title of proceedings The Journal of Physical Chemistry Letters
DOI 10.1021/acs.jpclett.7b00038

Open Access

Type of Open Access Repository (Green Open Access)