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@ARTICLE{Schrder:202942,
      author       = {Schröder, Gunnar},
      title        = {{H}ybrid methods for macromolecular structure
                      determination: experiment with expectations},
      journal      = {Current opinion in structural biology},
      volume       = {31},
      issn         = {0959-440X},
      address      = {Amsterdam [u.a.]},
      publisher    = {Elsevier},
      reportid     = {FZJ-2015-05065},
      pages        = {20 - 27},
      year         = {2015},
      abstract     = {Studies of large and heterogeneous macromolecules often
                      yield low-resolution data that alone does not suffice to
                      build accurate atomic models. Adding information from
                      molecular simulation or other structure prediction methods
                      can lead to models with significantly better quality.
                      Different strategies are discussed to combine experimental
                      data with results from simulation and prediction. This
                      review describes recent approaches for building atomic
                      models with a focus on X-ray diffraction and single-particle
                      cryo-electron microscopy (cryo-EM) data. In addition, both
                      cryo-EM and X-ray diffraction provide information on
                      molecular dynamics. Therefore, the best description of
                      molecular structures is often by an ensemble of models. It
                      furthermore becomes apparent that using raw data for the
                      modeling ensures that all information obtained by the
                      experiment can be fully exploited. It is also important to
                      quantify the errors of both experiment and simulation to
                      correctly weigh their different contributions.},
      cin          = {ICS-6},
      ddc          = {570},
      cid          = {I:(DE-Juel1)ICS-6-20110106},
      pnm          = {551 - Functional Macromolecules and Complexes (POF3-551)},
      pid          = {G:(DE-HGF)POF3-551},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000357706000005},
      pubmed       = {pmid:25795086},
      doi          = {10.1016/j.sbi.2015.02.016},
      url          = {https://juser.fz-juelich.de/record/202942},
}