Data for: "Assessment of GAFF and OPLS force fields for urea: crystal and aqueous solution properties"

Dataset

Description

This dataset contains the input files required to set-up and simulate bulk urea crystals, and to set-up and simulate bulk aqueous urea solutions.
Date made available7 Dec 2023
PublisherUniversity of Strathclyde
Date of data production1 Jan 2022 - 1 Nov 2023

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