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  • Topic: Parareal algorithms for molecular dynamics
    Description: The parareal algorithm, originally proposed in 2001, is a very efficient algorithm to solve initial-value problems (e.g. ODEs or SDEs) using parallel-in-time computations. The algorithm is based on a decomposition of the time interval into subintervals and exploits the presence of multiple processors to reduce the wall-clock time needed to obtain a solution on some time interval. The aim of the postdoc will be to develop new variants of the algorithm, better suited to the molecular dynamics context (where SDEs are considered on very long time horizons), and to test them on simple problems.
    Closing date: open until filled
    Contact: Frédéric Legoll ( and Tony Lelièvre ( Please contact us for more information!
    Posted in Jan 2022