Publications by authors named "Robert MeiSSner"

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Defect Migration in Supercrystalline Nanocomposites.
Dmitry Lapkin, Cong Yan, Emre Gürsoy, Hadas Sternlicht, Alexander Plunkett, Robert H Meissner

ACS Nano· December 2025

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Capacitive deionisation for water desalination review: experimental and simulation.
Rokhsareh Akbarzadeh, Mathias Ernst, Robert Meißner, Bodo Fiedler

Sci Technol Adv Mater· October 2025

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Atomistic Modeling of Functionalized Magnetite Surfaces with Oxidation States.
Emre Gürsoy, Robert H Meißner, Gregor B Vonbun-Feldbauer

J Phys Chem Lett· July 2025

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Smart Reaction Templating: A Graph-Based Method for Automated Molecular Dynamics Input Generation.
Julian Konrad, Robert Meißner

J Chem Inf Model· June 2025

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Demonstration of a Chemical Recycling Concept for Polybutylene Succinate Containing Waste Substrates via Coupled Enzymatic/Electrochemical Processes.
Richard Buchinger, Sabrina Bischof, Ole Nickel, Vanessa Grassi, Jasmin Antony

ChemSusChem· May 2025

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Efficient treatment of long-range electrostatics in charge equilibration approaches.
Kamila Savvidi, Ludwig Ahrens-Iwers, Lucio Colombi Ciacchi, Dirk Zahn, Martin H Müser

J Chem Phys· May 2025

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X-ray absorption spectroscopy reveals charge transfer in π-stacked aromatic amino acids.
Carlos Ortiz-Mahecha, Lucas Schwob, Juliette Leroux, Sadia Bari, Robert H Meißner

Phys Chem Chem Phys· April 2025

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Maximum Entropy-Mediated Liquid-to-Solid Nucleation and Transition.
Lars Dammann, Richard Kohns, Patrick Huber, Robert H Meißner

J Chem Theory Comput· February 2025

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Accounting for the Quantum Capacitance of Graphite in Constant Potential Molecular Dynamics Simulations.
Kateryna Goloviznina, Johann Fleischhaker, Tobias Binninger, Benjamin Rotenberg, Heigo Ers, Robert Meissner

Adv Mater· September 2024

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Deformation dynamics of nanopores upon water imbibition.
Juan Sanchez, Lars Dammann, Laura Gallardo, Zhuoqing Li, Michael Fröba

Proc Natl Acad Sci U S A· September 2024

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Water, Not Salt, Causes Most of the Seebeck Effect of Nonisothermal Aqueous Electrolytes.
Ole Nickel, Ludwig J V Ahrens-Iwers, Robert H Meißner, Mathijs Janssen

Phys Rev Lett· May 2024

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Integrating Explainability into Graph Neural Network Models for the Prediction of X-ray Absorption Spectra.
Amir Kotobi, Kanishka Singh, Daniel Höche, Sadia Bari, Robert H Meißner

J Am Chem Soc· October 2023

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Mapping the electronic transitions of protonation sites in peptides using soft X-ray action spectroscopy.
Juliette Leroux, Amir Kotobi, Konstantin Hirsch, Tobias Lau, Carlos Ortiz-Mahecha

Phys Chem Chem Phys· September 2023

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Oxidation-State Dynamics and Emerging Patterns in Magnetite.
Emre Gürsoy, Gregor B Vonbun-Feldbauer, Robert H Meißner

J Phys Chem Lett· August 2023

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Discovery of MK-8768, a Potent and Selective mGluR2 Negative Allosteric Modulator.
Michael T Rudd, Peter J Manley, Barbara Hanney, Zhaoyang Meng, Youheng Shu, Robert S Meissner

ACS Med Chem Lett· August 2023

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Discovery of [C]MK-8056: A Selective PET Imaging Agent for the Study of mGluR Negative Allosteric Modulators.
James J Perkins, Paul McQuade, Christopher J Bungard, Tracy L Diamond, Liza T Gantert, Robert S Meissner

ACS Med Chem Lett· July 2023

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Orientation order of a nonpolar molecular fluid compressed into a nanosmall space.
Dan Wang, Milena Lippmann, Johannes Gäding, Anita Ehnes, Dmitri Novikov

Nanoscale· May 2023

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Reconstructing the infrared spectrum of a peptide from representative conformers of the full canonical ensemble.
Amir Kotobi, Lucas Schwob, Gregor B Vonbun-Feldbauer, Mariana Rossi, Piero Gasparotto

Commun Chem· March 2023

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Adsorption of oleic acid on magnetite facets.
Marcus Creutzburg, Mine Konuk, Steffen Tober, Simon Chung, Björn Arndt

Commun Chem· October 2022

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ELECTRODE: An electrochemistry package for atomistic simulations.
Ludwig J V Ahrens-Iwers, Mathijs Janssen, Shern R Tee, Robert H Meißner

J Chem Phys· August 2022

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Atomistic Insight into the Hydration States of Layered Double Hydroxides.
Xuejiao Li, Tim Würger, Christian Feiler, Robert H Meißner, Maria Serdechnova

ACS Omega· April 2022

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Impact of confinement and polarizability on dynamics of ionic liquids.
Johannes Gäding, Gabriele Tocci, Mark Busch, Patrick Huber, Robert H Meißner

J Chem Phys· February 2022

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Elucidating Curvature-Capacitance Relationships in Carbon-Based Supercapacitors.
Jannes Seebeck, Céline Merlet, Robert H Meißner

Phys Rev Lett· February 2022

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Discovery and Preclinical Characterization of BIIB091, a Reversible, Selective BTK Inhibitor for the Treatment of Multiple Sclerosis.
Brian T Hopkins, Eris Bame, Bekim Bajrami, Cheryl Black, Tonika Bohnert, Robert Meissner

J Med Chem· January 2022

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Constant potential simulations on a mesh.
Ludwig J V Ahrens-Iwers, Robert H Meißner

J Chem Phys· September 2021

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