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 | 236 | 2015 |
Enhanced sampling methods for molecular dynamics simulations J Hénin, T Lelièvre, MR Shirts, O Valsson, L Delemotte arXiv preprint arXiv:2202.04164, 2022 | 200 | 2022 |
Intermediate states of the Kv1. 2 voltage sensor from atomistic molecular dynamics simulations L Delemotte, M Tarek, ML Klein, C Amaral, W Treptow Proceedings of the National Academy of Sciences 108 (15), 6109-6114, 2011 | 197 | 2011 |
Molecular dynamics simulations of lipid membrane electroporation L Delemotte, M Tarek The Journal of membrane biology 245 (9), 531-543, 2012 | 182 | 2012 |
Understanding TRPV1 activation by ligands: Insights from the binding modes of capsaicin and resiniferatoxin K Elokely, P Velisetty, L Delemotte, E Palovcak, ML Klein, T Rohacs, ... Proceedings of the National Academy of Sciences 113 (2), E137-E145, 2016 | 159 | 2016 |
Modeling membranes under a transmembrane potential L Delemotte, F Dehez, W Treptow, M Tarek The Journal of Physical Chemistry B 112 (18), 5547-5550, 2008 | 123 | 2008 |
Transport of siRNA through lipid membranes driven by nanosecond electric pulses: an experimental and computational study M Breton, L Delemotte, A Silve, LM Mir, M Tarek Journal of the American Chemical Society 134 (34), 13938-13941, 2012 | 104 | 2012 |
Conformational landscapes of membrane proteins delineated by enhanced sampling molecular dynamics simulations TJ Harpole, L Delemotte Biochimica Et Biophysica Acta (BBA)-Biomembranes 1860 (4), 909-926, 2018 | 94 | 2018 |
Gating pore currents are defects in common with two Nav1.5 mutations in patients with mixed arrhythmias and dilated cardiomyopathy A Moreau, P Gosselin-Badaroudine, L Delemotte, ML Klein, M Chahine Journal of General Physiology 145 (2), 93-106, 2015 | 84 | 2015 |
Gating pore currents and the resting state of Nav1. 4 voltage sensor domains P Gosselin-Badaroudine, L Delemotte, A Moreau, ML Klein, M Chahine Proceedings of the National Academy of Sciences 109 (47), 19250-19255, 2012 | 83 | 2012 |
Molecular insights from conformational ensembles via machine learning O Fleetwood, MA Kasimova, AM Westerlund, L Delemotte Biophysical Journal 118 (3), 765-780, 2020 | 77 | 2020 |
The molecular basis for sugar import in malaria parasites AA Qureshi, A Suades, R Matsuoka, J Brock, SE McComas, E Nji, ... Nature 578 (7794), 321-325, 2020 | 75 | 2020 |
Evolutionary imprint of activation: The design principles of VSDs E Palovcak, L Delemotte, ML Klein, V Carnevale Journal of General Physiology 143 (2), 145-156, 2014 | 74 | 2014 |
Gating interaction maps reveal a noncanonical electromechanical coupling mode in the Shaker K+ channel AI Fernández-Mariño, TJ Harpole, K Oelstrom, L Delemotte, B Chanda Nature structural & molecular biology 25 (4), 320-326, 2018 | 69 | 2018 |
Free-energy landscape of ion-channel voltage-sensor–domain activation L Delemotte, MA Kasimova, ML Klein, M Tarek, V Carnevale Proceedings of the National Academy of Sciences 112 (1), 124-129, 2015 | 68 | 2015 |
Effect of Ca2+ on the promiscuous target-protein binding of calmodulin AM Westerlund, L Delemotte PLoS computational biology 14 (4), e1006072, 2018 | 67 | 2018 |
Conduction in a biological sodium selective channel L Stock, L Delemotte, V Carnevale, W Treptow, ML Klein The journal of physical chemistry B 117 (14), 3782-3789, 2013 | 66 | 2013 |
Effect of sensor domain mutations on the properties of voltage-gated ion channels: molecular dynamics studies of the potassium channel Kv1. 2 L Delemotte, W Treptow, ML Klein, M Tarek Biophysical Journal 99 (9), L72-L74, 2010 | 65 | 2010 |
Comparative sequence analysis suggests a conserved gating mechanism for TRP channels E Palovcak, L Delemotte, ML Klein, V Carnevale Journal of General Physiology 146 (1), 37-50, 2015 | 63 | 2015 |
Helix breaking transition in the S4 of HCN channel is critical for hyperpolarization-dependent gating MA Kasimova, D Tewari, JB Cowgill, WC Ursuleaz, JL Lin, L Delemotte, ... Elife 8, e53400, 2019 | 57 | 2019 |