Density artefacts at interfaces caused by multiple time-step effects in molecular dynamics simulations

Dominik Sidler, Marc Lehner, Simon Frasch, Michael Cristófol-Clough, Sereina Riniker. Density artefacts at interfaces caused by multiple time-step effects in molecular dynamics simulations. F1000Research, 7:1745, 2018. [doi]

Authors

Dominik Sidler

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Marc Lehner

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Simon Frasch

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Michael Cristófol-Clough

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Sereina Riniker

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