Literature DB >> 21843464

Computational electrophysiology: the molecular dynamics of ion channel permeation and selectivity in atomistic detail.

Benoît Roux1.   

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Year:  2011        PMID： 21843464      PMCID： PMC3175060          DOI： 10.1016/j.bpj.2011.07.002

Source DB:  PubMed          Journal:  Biophys J        ISSN： 0006-3495            Impact factor:   4.033


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  4 in total

1.  Ion permeation and selectivity of OmpF porin: a theoretical study based on molecular dynamics, Brownian dynamics, and continuum electrodiffusion theory.

Authors:  Wonpil Im; Benoît Roux
Journal:  J Mol Biol       Date:  2002-09-27       Impact factor: 5.469

2.  Atomistic simulations of biologically realistic transmembrane potential gradients.

Authors:  Jonathan N Sachs; Paul S Crozier; Thomas B Woolf
Journal:  J Chem Phys       Date:  2004-12-08       Impact factor: 3.488

3.  The membrane potential and its representation by a constant electric field in computer simulations.

Authors:  Benoît Roux
Journal:  Biophys J       Date:  2008-07-18       Impact factor: 4.033

4.  Computational electrophysiology: the molecular dynamics of ion channel permeation and selectivity in atomistic detail.

Authors:  Carsten Kutzner; Helmut Grubmüller; Bert L de Groot; Ulrich Zachariae
Journal:  Biophys J       Date:  2011-08-17       Impact factor: 4.033
  4 in total
  4 in total

1.  Validity of the Electrodiffusion Model for Calculating Conductance of Simple Ion Channels.

Authors:  Andrew Pohorille; Michael A Wilson; Chenyu Wei
Journal:  J Phys Chem B       Date:  2016-12-12       Impact factor: 2.991

2.  Molecular dynamics simulations of membrane proteins under asymmetric ionic concentrations.

Authors:  Fatemeh Khalili-Araghi; Brigitte Ziervogel; James C Gumbart; Benoît Roux
Journal:  J Gen Physiol       Date:  2013-10       Impact factor: 4.086

3.  Quantum effects in cation interactions with first and second coordination shell ligands in metalloproteins.

Authors:  Van Ngo; Mauricio C da Silva; Maximilian Kubillus; Hui Li; Benoît Roux; Marcus Elstner; Qiang Cui; Dennis R Salahub; Sergei Yu Noskov
Journal:  J Chem Theory Comput       Date:  2015-10-05       Impact factor: 6.006

4.  Voltage Dependence of Conformational Dynamics and Subconducting States of VDAC-1.

Authors:  Rodolfo Briones; Conrad Weichbrodt; Licia Paltrinieri; Ingo Mey; Saskia Villinger; Karin Giller; Adam Lange; Markus Zweckstetter; Christian Griesinger; Stefan Becker; Claudia Steinem; Bert L de Groot
Journal:  Biophys J       Date:  2016-09-20       Impact factor: 4.033
  4 in total

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