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Appears in collection : Advances in computational statistical physics / Perspectives en physique statistique computationnelle

This talk is devoted to the presentation of algorithms for simulating rare events in a molecular dynamics context, e.g., the simulation of reactive paths. We will consider $\mathbb{R}^d$ as the space of configurations for a given system, where the probability of a specific configuration is given by a Gibbs measure depending on a temperature parameter. The dynamics of the system is given by an overdamped Langevin (or gradient) equation. The problem is to find how the system can evolve from a local minimum of the potential to another, following the above dynamics. After a brief overview of classical Monte Carlo methods, we will expose recent results on adaptive multilevel splitting techniques.

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Citation data

  • DOI 10.24350/CIRM.V.19446103
  • Cite this video Guyader, Arnaud (18/09/2018). Rare event simulation for molecular dynamics. CIRM. Audiovisual resource. DOI: 10.24350/CIRM.V.19446103
  • URL https://dx.doi.org/10.24350/CIRM.V.19446103

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