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Lucie Delemotte

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Publication Activity (10 Years)

Years Active: 2017-2023
Publications (10 Years): 32

Top Venues

eLife

The Journal of general physiology

bioRxiv : the preprint server for biology

PLoS computational biology

Kungliga Tekniska Högskolan

Université de Lorraine (PHD)

This page only lists publications with an associated author ORCID identifier.

Affiliation History

Kungliga Tekniska Högskolan Feb 16o 2016

Sweden

Assistant Professor :: Theoretical Physics

Education History

Université de Lorraine Oct 1o 2008 - Sep 22o 2011

France

PHD :: Chemistry

Publications

Darko Mitrovic, Yue Chen, Antoni Marciniak, Lucie Delemotte
Coevolution-Driven Method for Efficiently Simulating Conformational Changes in Proteins Reveals Molecular Details of Ligand Effects in the β2AR Receptor. The journal of physical chemistry. B (2023)
Sook Wah Yee, Christian B Macdonald, Darko Mitrovic, Xujia Zhou, Megan L Koleske, Jia Yang, Dina Buitrago Silva, Patrick Rockefeller Grimes, Donovan D Trinidad, Swati S More, Linda Kachuri, John S Witte, Lucie Delemotte, Kathleen M Giacomini, Willow Coyote-Maestas
The full spectrum of OCT1 (SLC22A1) mutations bridges transporter biophysics to drug pharmacogenomics. bioRxiv : the preprint server for biology (2023)
Sarah E McComas, Tom Reichenbach, Darko Mitrovic, Claudia Alleva, Marta Bonaccorsi, Lucie Delemotte, David Drew
Determinants of sugar-induced influx in the mammalian fructose transporter GLUT5. eLife 12 (2023)
Koushik Choudhury, Lucie Delemotte
Modulation of Pore Opening of Eukaryotic Sodium Channels by π-Helices in S6. The journal of physical chemistry letters (2023)
Ahmad Elbahnsi, John Cowgill, Verena Burtscher, Linda Wedemann, Luise Zeckey, Baron Chanda, Lucie Delemotte
Interplay between VSD, pore and membrane lipids in electromechanical coupling in HCN channels. eLife 12 (2023)
Johanna K S Tiemann, Magdalena Szczuka, Lisa Bouarroudj, Mohamed Oussaren, Steven Garcia, Rebecca J Howard, Lucie Delemotte, Erik Lindahl, Marc Baaden, Kresten Lindorff-Larsen, Matthieu Chavent, Pierre Poulain
MDverse: Shedding Light on the Dark Matter of Molecular Dynamics Simulations. bioRxiv : the preprint server for biology (2023)
Darko Mitrovic, Sarah E McComas, Claudia Alleva, Marta Bonaccorsi, David Drew, Lucie Delemotte
Reconstructing the transport cycle in the sugar porter superfamily using coevolution-powered machine learning. eLife 12 (2023)
Johanna K S Tiemann, Magdalena Szczuka, Lisa Bouarroudj, Mohamed Oussaren, Steven Garcia, Rebecca J Howard, Lucie Delemotte, Erik Lindahl, Marc Baaden, Kresten Lindorff-Larsen, Matthieu Chavent, Pierre Poulain
MDverse: Shedding Light on the Dark Matter of Molecular Dynamics Simulations. bioRxiv : the preprint server for biology (2023)
Gamma Chi, Qiansheng Liang, Akshay Sridhar, John B Cowgill, Kasim Sader, Mazdak Radjainia, Pu Qian, Pablo Castro-Hartmann, Shayla Venkaya, Nanki Kaur Singh, Gavin McKinley, Alejandra Fernandez-Cid, Shubhashish M M Mukhopadhyay, Nicola A Burgess-Brown, Lucie Delemotte, Manuel Covarrubias, Katharina L Dürr
Cryo-EM structure of the human Kv3.1 channel reveals gating control by the cytoplasmic T1 domain. Nature communications 13 (1) (2022)
Koushik Choudhury, Rebecca J Howard, Lucie Delemotte
An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb. The Journal of general physiology 155 (2) (2022)
Koushik Choudhury, Rebecca J Howard, Lucie Delemotte
An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb. The Journal of general physiology 155 (2) (2022)
Annie M Westerlund, Akshay Sridhar, Leo Dahl, Alma Andersson, Anna-Yaroslava Bodnar, Lucie Delemotte
Markov state modelling reveals heterogeneous drug-inhibition mechanism of Calmodulin. PLoS computational biology 18 (10) (2022)
Koushik Choudhury, Rebecca J Howard, Lucie Delemotte
An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb. The Journal of general physiology 155 (2) (2022)
Damon J A Frampton, Koushik Choudhury, Johan E Larsson, Lucie Delemotte, Sara I Liin
Subtype-specific responses of hKv7.4 and hKv7.5 channels to polyunsaturated fatty acids reveal an unconventional modulatory site and mechanism. eLife 11 (2022)
Lea Rems, Xinru Tang, Fangwei Zhao, Sergio Pérez-Conesa, Ilaria Testa, Lucie Delemotte
Identification of electroporation sites in the complex lipid organization of the plasma membrane. eLife 11 (2022)
Koushik Choudhury, Rebecca J Howard, Lucie Delemotte
An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb. The Journal of general physiology 155 (2) (2022)
Koushik Choudhury, Rebecca J Howard, Lucie Delemotte
An α-π transition in S6 shapes the conformational cycle of the bacterial sodium channel NavAb. The Journal of general physiology 155 (2) (2022)
Annie M Westerlund, Oliver Fleetwood, Sergio Pérez-Conesa, Lucie Delemotte
Network analysis reveals how lipids and other cofactors influence membrane protein allostery. The Journal of chemical physics 153 (14) (2021)
Sergio Pérez-Conesa, Eric G Keeler, Dongyu Zhang, Lucie Delemotte, Ann E McDermott
Informing NMR experiments with molecular dynamics simulations to characterize the dominant activated state of the KcsA ion channel. The Journal of chemical physics 154 (16) (2021)
Iacopo Galleano, Hendrik Harms, Koushik Choudhury, Keith K Khoo, Lucie Delemotte, Stephan Alexander Pless
Functional cross-talk between phosphorylation and disease-causing mutations in the cardiac sodium channel Nav1.5. Proceedings of the National Academy of Sciences of the United States of America 118 (33) (2021)
Oliver Fleetwood, Jens Carlsson, Lucie Delemotte
Identification of ligand-specific G protein-coupled receptor states and prediction of downstream efficacy via data-driven modeling. eLife 10 (2021)
Yue Chen, Oliver Fleetwood, Sergio Pérez-Conesa, Lucie Delemotte
Allosteric Effect of Nanobody Binding on Ligand-Specific Active States of the β2 Adrenergic Receptor. Journal of chemical information and modeling (2021)
Po Wei Kang, Annie M Westerlund, Jingyi Shi, Kelli McFarland White, Alex K Dou, Amy H Cui, Jonathan R Silva, Lucie Delemotte, Jianmin Cui
Calmodulin acts as a state-dependent switch to control a cardiac potassium channel opening. Science advances 6 (50) (2020)
Oliver Fleetwood, Pierre Matricon, Jens Carlsson, Lucie Delemotte
Energy Landscapes Reveal Agonist Control of G Protein-Coupled Receptor Activation via Microswitches. Biochemistry 59 (7) (2020)
Marina A Kasimova, Debanjan Tewari, John B Cowgill, Willy Carrasquel Ursuleaz, Jenna L Lin, Lucie Delemotte, Baron Chanda
Helix breaking transition in the S4 of HCN channel is critical for hyperpolarization-dependent gating. eLife 8 (2019)
Mark Abraham, Rossen Apostolov, Jonathan Barnoud, Paul Bauer, Christian Blau, Alexandre M J J Bonvin, Matthieu Chavent, John D Chodera, Karmen Čondić-Jurkić, Lucie Delemotte, Helmut Grubmüller, Rebecca J Howard, E Joseph Jordan, Erik Lindahl, O H Samuli Ollila, Jana Selent, Daniel G A Smith, Phillip J Stansfeld, Johanna K S Tiemann, Mikael Trellet, Christopher Woods, Artem Zhmurov
Sharing Data from Molecular Simulations. Journal of chemical information and modeling 59 (10) (2019)
Annie M Westerlund, Lucie Delemotte
InfleCS: Clustering Free Energy Landscapes with Gaussian Mixtures. Journal of chemical theory and computation 15 (12) (2019)
Marina A Kasimova, Erik Lindahl, Lucie Delemotte
Determining the molecular basis of voltage sensitivity in membrane proteins. The Journal of general physiology 150 (10) (2018)
Alma E V Andersson, Marina A Kasimova, Lucie Delemotte
Exploring the Viral Channel KcvPBCV-1 Function via Computation. The Journal of membrane biology 251 (3) (2018)
Lucie Delemotte
Opening leads to closing: Allosteric crosstalk between the activation and inactivation gates in KcsA. The Journal of general physiology 150 (10) (2018)
Annie M Westerlund, Lucie Delemotte
Effect of Ca2+ on the promiscuous target-protein binding of calmodulin. PLoS computational biology 14 (4) (2018)
Annie M Westerlund, Tyler J Harpole, Christian Blau, Lucie Delemotte
Inference of Calmodulin's Ca2+-Dependent Free Energy Landscapes via Gaussian Mixture Model Validation. Journal of chemical theory and computation 14 (1) (2017)

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Publication Activity (10 Years)

Top Topics

Top Venues

Lucie Delemotte