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LEARNING MATTER

Temperature-transferable coarse-graining of ionic liquids with dual graph convolutional neural networks

Submitted by jruza@mit.edu on Thu, 2020-08-06 07:45

J. Ruza, Wang, W., Schwalbe-Koda, D., Axelrod, S., Harris, W. Hunt, and Gómez-Bombarelli,  R., “Temperature-transferable coarse-graining of ionic liquids with dual graph convolutional neural networks”, The Journal of Chemical Physics, vol. 153, p. 164501, 2020.
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