Prati
Jérôme Hénin
Jérôme Hénin
CNRS, IBPC, LBT
Potvrđena adresa e-pošte na cnrs.fr - Početna stranica
Naslov
Citirano
Citirano
Godina
Scalable molecular dynamics on CPU and GPU architectures with NAMD
JC Phillips, DJ Hardy, JDC Maia, JE Stone, JV Ribeiro, RC Bernardi, ...
The Journal of chemical physics 153 (4), 2020
19852020
Using collective variables to drive molecular dynamics simulations
G Fiorin, ML Klein, J Hénin
Molecular Physics 111 (22-23), 3345-3362, 2013
9182013
Overcoming free energy barriers using unconstrained molecular dynamics simulations
J Hénin, C Chipot
The Journal of chemical physics 121 (7), 2904-2914, 2004
5412004
The adaptive biasing force method: Everything you always wanted to know but were afraid to ask
J Comer, JC Gumbart, J Hénin, T Lelièvre, A Pohorille, C Chipot
The Journal of Physical Chemistry B 119 (3), 1129-1151, 2015
4702015
Exploring multidimensional free energy landscapes using time-dependent biases on collective variables
J Hénin, G Fiorin, C Chipot, ML Klein
Journal of Chemical Theory and Computation 6 (1), 35-47, 2009
4442009
Membrane protein structure, function, and dynamics: a perspective from experiments and theory
Z Cournia, TW Allen, I Andricioaei, B Antonny, D Baum, G Brannigan, ...
The Journal of membrane biology 248, 611-640, 2015
2342015
Enhanced sampling methods for molecular dynamics simulations
J Hénin, T Lelièvre, MR Shirts, O Valsson, L Delemotte
arXiv preprint arXiv:2202.04164, 2022
1922022
CHARMM36 united atom chain model for lipids and surfactants
S Lee, A Tran, M Allsopp, JB Lim, J Hénin, JB Klauda
The journal of physical chemistry B 118 (2), 547-556, 2014
1882014
Embedded cholesterol in the nicotinic acetylcholine receptor
G Brannigan, J Hénin, R Law, R Eckenhoff, ML Klein
Proceedings of the National Academy of Sciences 105 (38), 14418-14423, 2008
1872008
Insights into the recognition and association of transmembrane α-helices. The free energy of α-helix dimerization in glycophorin A
J Hénin, A Pohorille, C Chipot
Journal of the American Chemical Society 127 (23), 8478-8484, 2005
1702005
Type VI secretion and bacteriophage tail tubes share a common assembly pathway
YR Brunet, J Hénin, H Celia, E Cascales
EMBO reports 15 (3), 315-321, 2014
1422014
Multiple binding sites for the general anesthetic isoflurane identified in the nicotinic acetylcholine receptor transmembrane domain
G Brannigan, DN LeBard, J Hénin, RG Eckenhoff, ML Klein
Proceedings of the National Academy of Sciences 107 (32), 14122-14127, 2010
1412010
Exploring the free-energy landscape of a short peptide using an average force
C Chipot, J Hénin
The Journal of chemical physics 123 (24), 2005
1392005
Diffusion of Glycerol through Escherichia coli Aquaglyceroporin GlpF
J Hénin, E Tajkhorshid, K Schulten, C Chipot
Biophysical Journal 94 (3), 832-839, 2008
1272008
Smoothed biasing forces yield unbiased free energies with the extended-system adaptive biasing force method
A Lesage, T Lelièvre, G Stoltz, J Hénin
The Journal of Physical Chemistry B 121 (15), 3676-3685, 2017
1262017
Evolution of pentameric ligand-gated ion channels: Pro-loop receptors
M Jaiteh, A Taly, J Hénin
PloS one 11 (3), e0151934, 2016
1192016
United-atom acyl chains for CHARMM phospholipids
J Hénin, W Shinoda, ML Klein
The Journal of Physical Chemistry B 112 (23), 7008-7015, 2008
1022008
Single-spanning transmembrane domains in cell growth and cell-cell interactions: More than meets the eye?
P Hubert, P Sawma, JP Duneau, J Khao, J Hénin, D Bagnard, J Sturgis
Cell adhesion & migration 4 (2), 313-324, 2010
932010
A predicted binding site for cholesterol on the GABAA receptor
J Hénin, R Salari, S Murlidaran, G Brannigan
Biophysical journal 106 (9), 1938-1949, 2014
922014
Lipid concentration and molar ratio boundaries for the use of isotropic bicelles
M Beaugrand, AA Arnold, J Hénin, DE Warschawski, PTF Williamson, ...
Langmuir 30 (21), 6162-6170, 2014
832014
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