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Analysis of the adaptive multilevel splitting method on the isomerization of alanine dipeptide

Laura J S Lopes1, Tony Lelièvre1

  • 1CERMICS, École des Ponts ParisTech, 6-8 Avenue Blaise Pascal, 77455, Marne-la-Vallée, France.

Journal of Computational Chemistry
|January 31, 2019
PubMed

Keywords:
adaptive multilevel splittingalanine dipeptidecommittor functionmolecular dynamicsrare events

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