An automated force field topology builder (ATB) and repository: version 1.0 AK Malde, L Zuo, M Breeze, M Stroet, D Poger, PC Nair, C Oostenbrink, ... Journal of chemical theory and computation 7 (12), 4026-4037, 2011 | 1885 | 2011 |
A new force field for simulating phosphatidylcholine bilayers D Poger, WF Van Gunsteren, AE Mark Journal of computational chemistry 31 (6), 1117-1125, 2010 | 396 | 2010 |
On the Validation of Molecular Dynamics Simulations of Saturated and cis-Monounsaturated Phosphatidylcholine Lipid Bilayers: A Comparison with Experiment D Poger, AE Mark Journal of Chemical Theory and Computation 6 (1), 325-336, 2010 | 347 | 2010 |
A ring to rule them all: the effect of cyclopropane fatty acids on the fluidity of lipid bilayers D Poger, AE Mark The journal of physical chemistry B 119 (17), 5487-5495, 2015 | 148 | 2015 |
Validating lipid force fields against experimental data: Progress, challenges and perspectives D Poger, B Caron, AE Mark Biochimica et Biophysica Acta (BBA)-Biomembranes 1858 (7), 1556-1565, 2016 | 104 | 2016 |
Effect of methyl-branched fatty acids on the structure of lipid bilayers D Poger, B Caron, AE Mark The Journal of Physical Chemistry B 118 (48), 13838-13848, 2014 | 95 | 2014 |
Lipid bilayers: The effect of force field on ordering and dynamics D Poger, AE Mark Journal of chemical theory and computation 8 (11), 4807-4817, 2012 | 92 | 2012 |
Real cost of speed: the effect of a time-saving multiple-time-stepping algorithm on the accuracy of molecular dynamics simulations S Reißer, D Poger, M Stroet, AE Mark Journal of chemical theory and computation 13 (6), 2367-2372, 2017 | 58 | 2017 |
The relative effect of sterols and hopanoids on lipid bilayers: when comparable is not identical D Poger, AE Mark The Journal of Physical chemistry B 117 (50), 16129-16140, 2013 | 53 | 2013 |
Effect of triclosan and chloroxylenol on bacterial membranes D Poger, AE Mark The Journal of Physical Chemistry B 123 (25), 5291-5301, 2019 | 36 | 2019 |
Could cardiolipin protect membranes against the action of certain antimicrobial peptides? Aurein 1.2, a case study D Poger, S Poyry, AE Mark ACS omega 3 (12), 16453-16464, 2018 | 31 | 2018 |
Some like it hot: the effect of sterols and hopanoids on lipid ordering at high temperature B Caron, AE Mark, D Poger The journal of physical chemistry letters 5 (22), 3953-3957, 2014 | 31 | 2014 |
Effect of high pressure on fully hydrated DPPC and POPC bilayers R Chen, D Poger, AE Mark The Journal of Physical Chemistry B 115 (5), 1038-1044, 2011 | 31 | 2011 |
Turning the growth hormone receptor on: evidence that hormone binding induces subunit rotation D Poger, AE Mark Proteins: Structure, Function, and Bioinformatics 78 (5), 1163-1174, 2010 | 30 | 2010 |
The effect of hydronium ions on the structure of phospholipid membranes E Deplazes, D Poger, B Cornell, CG Cranfield Physical Chemistry Chemical Physics 20 (1), 357-366, 2018 | 29 | 2018 |
Interplay between glutathione, Atx1 and copper: X-ray absorption spectroscopy determination of Cu (I) environment in an Atx1 dimer D Poger, C Fillaux, R Miras, S Crouzy, P Delangle, E Mintz, C Den Auwer, ... JBIC Journal of Biological Inorganic Chemistry 13, 1239-1248, 2008 | 29 | 2008 |
New model potentials for sulfur–copper(I) and sulfur–mercury(II) interactions in proteins: From ab initio to molecular dynamics JF Fuchs, H Nedev, D Poger, M Ferrand, V Brenner, JP Dognon, S Crouzy Journal of computational chemistry 27 (7), 837-856, 2006 | 27 | 2006 |
Molecular dynamics study of the metallochaperone Hah1 in its apo and Cu (I)-loaded states: role of the conserved residue M10 D Poger, JF Fuchs, H Nedev, M Ferrand, S Crouzy FEBS letters 579 (24), 5287-5292, 2005 | 23 | 2005 |
Determining the structure of interfacial peptide films: comparing neutron reflectometry and molecular dynamics simulations Y Xue, L He, APJ Middelberg, AE Mark, D Poger Langmuir 30 (33), 10080-10089, 2014 | 21 | 2014 |
Activation of the epidermal growth factor receptor: a series of twists and turns D Poger, AE Mark Biochemistry 53 (16), 2710-2721, 2014 | 15 | 2014 |