4 code implementations • 7 Dec 2018 • Christoph Klein, Andrew Z. Summers, Matthew W. Thompson, Justin Gilmer, Clare McCabe, Peter T. Cummings, Janos Sallai, Christopher R. Iacovella
A key component to enhancing reproducibility in the molecular simulation community is reducing ambiguity in the parameterization of molecular models.
Computational Physics Soft Condensed Matter