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20052024
most citedAdaptive Resolution Molecular Dynamics Simulation: Changing the Degrees of Freedom on the Fly

430 citations · 1.5k across the 27 of their papers we have counts for

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Showing 2018 · physics.comp-phShow all

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physics.comp-ph2018★ 33 cited

Adaptive Resolution Molecular Dynamics Technique: Down to the Essential

Christian Krekeler, Animesh Agarwal, Christoph Junghans +2

We investigate the role of the thermodynamic (TD) force, as an essential and sufficient technical ingredient for an efficient and accurate adaptive resolution algorithm. Such a for…