AdaptiveBandit: A Multi-armed Bandit Framework for Adaptive Sampling in Molecular Simulations

  1. Pérez, A.
  2. Herrera-Nieto, P.
  3. Doerr, S.
  4. De Fabritiis, G.
Journal:
Journal of Chemical Theory and Computation

ISSN: 1549-9626 1549-9618

Year of publication: 2020

Volume: 16

Issue: 7

Pages: 4685-4693

Type: Article

DOI: 10.1021/ACS.JCTC.0C00205 GOOGLE SCHOLAR