Cation Selectivity in Biological Cation Channels Using Experimental Structural Information and Statistical Mechanical Simulation

• Justin John Finnerty ,

  * E-mail: j.finnerty@grs-sim.de (JF); a.peyser@fz-juelich.de (AP)

  Affiliation Computational Biophysics, German Research School for Simulation Sciences, 52425 Jülich, Germany

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• Alexander Peyser ,

  Contributed equally to this work with: Alexander Peyser, Paolo Carloni

  * E-mail: j.finnerty@grs-sim.de (JF); a.peyser@fz-juelich.de (AP)

  Affiliations Computational Biophysics, German Research School for Simulation Sciences, 52425 Jülich, Germany, Simulation Lab Neuroscience—Bernstein Facility for Simulation and Database Technology, Institute for Advanced Simulation, Jülich Aachen Research Alliance, Forschungszentrum Jülich, 52425 Jülich, Germany

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• Paolo Carloni

  Contributed equally to this work with: Alexander Peyser, Paolo Carloni

  Affiliations Computational Biophysics, German Research School for Simulation Sciences, 52425 Jülich, Germany, Computational Biomedicine, Institute for Neuroscience and Medicine (INM-9) and Institute for Advanced Simulation (IAS-5), Forschungszentrum Jülich, 52425 Jülich, Germany

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