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@ARTICLE{Raghavan:1005446,
      author       = {Raghavan, Bharath and Schackert, Florian K. and Levy,
                      Andrea and Johnson, Sophia K. and Ippoliti, Emiliano and
                      Mandelli, Davide and Olsen, Jógvan Magnus Haugaard and
                      Rothlisberger, Ursula and Carloni, Paolo},
      title        = {{M}i{M}i{CP}y: {A}n {E}fficient {T}oolkit for
                      {M}i{M}i{C}-{B}ased {QM}/{MM} {S}imulations},
      journal      = {Journal of chemical information and modeling},
      volume       = {63},
      number       = {5},
      issn         = {0095-2338},
      address      = {Washington, DC},
      publisher    = {American Chemical Society},
      reportid     = {FZJ-2023-01477},
      pages        = {1406 - 1412},
      year         = {2023},
      cin          = {IAS-5 / INM-9},
      ddc          = {540},
      cid          = {I:(DE-Juel1)IAS-5-20120330 / I:(DE-Juel1)INM-9-20140121},
      pnm          = {5241 - Molecular Information Processing in Cellular Systems
                      (POF4-524)},
      pid          = {G:(DE-HGF)POF4-5241},
      typ          = {PUB:(DE-HGF)16},
      pubmed       = {36811959},
      UT           = {WOS:000950345500001},
      doi          = {10.1021/acs.jcim.2c01620},
      url          = {https://juser.fz-juelich.de/record/1005446},
}