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Temperature-transferable coarse-graining of ionic liquids with dual graph convolutional neural networks
Thu, 2020-08-06 07:45
Ruza, Jurgis
Wang, Wujie
Daniel Schwalbe-Koda
Simon Axelrod
Harris, William Hunt
Rafael Gómez-Bombarelli
Temperature-transferable coarse-graining of ionic liquids with dual graph convolutional neural networks
The Journal of Chemical Physics
,
vol.
153
,
pp.
164501
,
2020
.
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