| Structure and dynamics of a proton wire: a theoretical study of H+ translocation along the single-file water chain in the gramicidin A channel. R Pomes, B Roux Biophysical journal 71 (1), 19, 1996 | 303 | 1996 |
| Proline and glycine control protein self-organization into elastomeric or amyloid fibrils S Rauscher, S Baud, M Miao, FW Keeley, R Pomes Structure 14 (11), 1667-1676, 2006 | 282 | 2006 |
| Molecular mechanism of H+ conduction in the single-file water chain of the gramicidin channel R Pomès, B Roux Biophysical journal 82 (5), 2304-2316, 2002 | 275 | 2002 |
| Thermodynamic stability of water molecules in the bacteriorhodopsin proton channel: a molecular dynamics free energy perturbation study B Roux, M Nina, R Pomes, JC Smith Biophysical journal 71 (2), 670-681, 1996 | 253 | 1996 |
| Free energy profiles for H+ conduction along hydrogen-bonded chains of water molecules R Pomès, B Roux Biophysical journal 75 (1), 33-40, 1998 | 221 | 1998 |
| Statistical convergence of equilibrium properties in simulations of molecular solutes embedded in lipid bilayers C Neale, WFD Bennett, DP Tieleman, R Pomes Journal of Chemical Theory and Computation 7 (12), 4175-4188, 2011 | 162 | 2011 |
| Molecular basis of proton blockage in aquaporins N Chakrabarti, E Tajkhorshid, B Roux, R Pomès Structure 12 (1), 65-74, 2004 | 156 | 2004 |
| Theoretical Study of H+ Translocation along a Model Proton Wire R Pomes, B Roux The Journal of Physical Chemistry 100 (7), 2519-2527, 1996 | 129 | 1996 |
| Structural determinants of proton blockage in aquaporins N Chakrabarti, B Roux, R Pomès Journal of molecular biology 343 (2), 493-510, 2004 | 113 | 2004 |
| Enhancing the accuracy, the efficiency and the scope of free energy simulations T Rodinger, R Pomès Current opinion in structural biology 15 (2), 164-170, 2005 | 101 | 2005 |
| Structure and dynamics of a proton shuttle in cytochrome c oxidase R Pomès, G Hummer, M Wikström Biochimica et Biophysica Acta (BBA)-Bioenergetics 1365 (1-2), 255-260, 1998 | 98 | 1998 |
| Computational approaches to the rational design of nanoemulsions, polymeric micelles, and dendrimers for drug delivery L Huynh, C Neale, R Pomès, C Allen Nanomedicine: nanotechnology, biology and medicine 8 (1), 20-36, 2012 | 90 | 2012 |
| Catalysis of Na+ permeation in the bacterial sodium channel NaVAb N Chakrabarti, C Ing, J Payandeh, N Zheng, WA Catterall, R Pomès Proceedings of the National Academy of Sciences 110 (28), 11331-11336, 2013 | 89 | 2013 |
| An iris-like mechanism of pore dilation in the CorA magnesium transport system N Chakrabarti, C Neale, J Payandeh, EF Pai, R Pomès Biophysical journal 98 (5), 784-792, 2010 | 83 | 2010 |
| Molecular simulations of protein disorder S Rauscher, R Pomès Biochemistry and cell biology 88 (2), 269-290, 2010 | 81 | 2010 |
| Quantum effects on the structure and energy of a protonated linear chain of hydrogen-bonded water molecules R Pomès, B Roux Chemical physics letters 234 (4-6), 416-424, 1995 | 73 | 1995 |
| Accelerating convergence in molecular dynamics simulations of solutes in lipid membranes by conducting a random walk along the bilayer normal C Neale, C Madill, S Rauscher, R Pomes Journal of chemical theory and computation 9 (8), 3686-3703, 2013 | 72 | 2013 |
| A combined molecular dynamics and diffusion model of single proton conduction through gramicidin MF Schumaker, R Pomès, B Roux Biophysical Journal 79 (6), 2840-2857, 2000 | 72 | 2000 |
| A scalable FPGA-based multiprocessor A Patel, CA Madill, M Saldana, C Comis, R Pomes, P Chow 2006 14th Annual IEEE Symposium on Field-Programmable Custom Computing …, 2006 | 69 | 2006 |
| Improving internal peptide dynamics in the coarse-grained MARTINI model: toward large-scale simulations of amyloid-and elastin-like peptides M Seo, S Rauscher, R Pomès, DP Tieleman Journal of chemical theory and computation 8 (5), 1774-1785, 2012 | 68 | 2012 |
Benoit RouxProfessor of Biochemistry, The university of ChicagoVerified email at uchicago.edu
