Machine Learning of Free Energies in Chemical Compound Space Using Ensemble Representations: Reaching Experimental Uncertainty for Solvation

This is a publication. If there is no link to the publication on this page, you can try the pre-formated search via the search engines listed on this page.

Authors: Jan Weinreich, Nicholas J. Browning, O. Anatole von Lilienfeld

Journal title: J. Chem. Phys.

Journal number: 154

Journal publisher: arXiv

Published year: 2021

Published pages: 134113

DOI identifier: 10.1063/5.0041548