Benoit Roux

发表

Using multiscale preconditioning to accelerate the convergence of iterative molecular calculations.

Bo Qi, Jonathan Weare, Aaron R Dinner, 2014, The Journal of chemical physics.

Nano-positioning system for structural analysis of functional homomeric proteins in multiple conformations.

Francisco Bezanilla, Walter Sandtner, Benoit Roux, 2012, Structure.

Imaging the electrostatic potential of transmembrane channels: atomic probe microscopy of OmpF porin.

Ansgar Philippsen, Wonpil Im, Daniel J Müller, 2002, Biophysical journal.

Simulation study of ion pairing in concentrated aqueous salt solutions with a polarizable force field.

Alexander D. MacKerell, Wei Jiang, Yun Luo, 2013, Faraday discussions.

Benoit Roux, Regis Pomes, B. Roux, 1999 .

On the Importance of Atomic Fluctuations, Protein Flexibility, and Solvent in Ion Permeation

Benoit Roux, B. Roux, T. Allen, 2004, The Journal of general physiology.

Reproducibility of Free Energy Calculations across Different Molecular Simulation Software Packages.

Julien Michel, Stefano Bosisio, Donghyuk Suh, 2018, Journal of chemical theory and computation.

Dynamics transitions at the outer vestibule of the KcsA potassium channel during gating

Eduardo Perozo, Benoit Roux, Shahidul M Islam, 2014, Proceedings of the National Academy of Sciences.

Benoit Roux, B. Roux, D. Papazian, 2003, Nature Reviews Neuroscience.

Molecular modeling and dynamics studies with explicit inclusion of electronic polarizability: theory and applications

Pedro E. M. Lopes, Benoit Roux, B. Roux, 2009, Theoretical chemistry accounts.

Molecular dynamics - potential of mean force calculations as a tool for understanding ion permeation and selectivity in narrow channels.

Toby W Allen, Benoit Roux, Olaf S Andersen, 2006, Biophysical chemistry.

Using Markov models to simulate electron spin resonance spectra from molecular dynamics trajectories.

Jack H Freed, Benoit Roux, Deniz Sezer, 2008, The journal of physical chemistry. B.

Importance of Hydration and Dynamics on the Selectivity of the KcsA and NaK Channels

Benoit Roux, B. Roux, S. Noskov, 2007, The Journal of general physiology.

Dynamic Coupling between the SH2 and SH3 Domains of c-Src and Hck Underlies Their Inactivation by C-Terminal Tyrosine Phosphorylation

Giulio Superti-Furga, John Kuriyan, Benoit Roux, 2001, Cell.