softmaterialslab / nanoconfinement-md

This code allows users to simulate ions confined between material surfaces that are nanometers apart, and extract the associated ionic structure.
Apache License 2.0
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nanoHUB app updates #169

Closed kadupitiya closed 2 years ago

kadupitiya commented 2 years ago

@jadhao: Updates for the nanoHUB app with new ML surrogate. Please check and approve.