author = "Jonas Feldt and Sebasti{\~a}o Salvador de Miranda and Frederico Pratas and Nuno Roma and Pedro Tom{\'a}s and Ricardo Mata",
   title = "Optimization and benchmarking of a perturbative Metropolis Monte Carlo quantum mechanics/molecular mechanics program",
   journal = "Journal of Chemical Physics",
   volume = 147,
   publisher = "American Institute of Physics",
   number = 244105,
   year = 2017,
   month = dec,
   BibTexOrigem = "13541 www.Inesc-ID.pt 2020-07-14"

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