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Theoretical chemistry / Metadynamics / Local Elevation / Umbrella sampling / Crystal structure / Parallel tempering / Force field / Concurrent Versions System / Simulation / Chemistry / Computational chemistry / Molecular dynamics


Advanced Review Metadynamics Alessandro Barducci, Massimiliano Bonomi and Michele Parrinello∗ Metadynamics is a powerful technique for enhancing sampling in molecular dynamics simulations and reconstructing the free-e
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Document Date: 2013-12-07 03:05:38

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