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6 results in Authors: Kasper B. Pedersen

Inorganic Chemistry

A Palladium Cluster-Organic Framework

Xiyue Liu, James N. McPherson, Carl Emil Andersen, Mike S. B. Jørgensen, René Wugt Larsen, Fabrice Wilhelm, Andrei Rogalev, Christian Göb, Kasper Steen Pedersen

Version 1 posted 05 September 2023

321

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Theoretical and Computational Chemistry

On the Automatic Optimization of Lipid Models in the Martini Force Field using SwarmCG

Charly Empereur-mot, Kasper B. Pedersen, Riccardo Capelli, Martina Crippa, Cristina Caruso, Mattia Perrone, Paulo C.T. Souza, Siewert J. Marrink, Giovanni M. Pavan

Version 2 posted 06 April 2023

371

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1

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Physical Chemistry

Characterization of deformational isomerization potential and interconversion dynamics with ultrafast x-ray solution scattering

Natalia E. Powers-Riggs, Benedikt O. Birgisson, Sumana Raj, Elisa Biasin, Philipp Lenzen, Diana Bregenholt Zederkof, Morten Haubro, Dagrún K. V. Tveiten, Robert Hartsock, Tim B. van Driel, Kristjan Kunnus, Matthieu Chollet, Joseph Robinson, Silke Nelson, Ruaridh Forbes, Kristoffer Haldrup, Kasper Steen Pedersen, Gianluca Levi, Asmus Ougaard Dohn, Hannes Jónsson, Klaus Braagaard Møller, Adi Natan, Martin Meedom Nielsen, Kelly Gaffney

Version 1 posted 29 March 2024

291

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Theoretical and Computational Chemistry

OLIVES: A Go-like Model for Stabilizing Protein Structure via Hydrogen Bonding Native Contacts in the Martini 3 Coarse-Grained Force Field

Kasper B. Pedersen, Luís Borges-Araújo, Amanda D. Stange, Paulo C. T. Souza, Siewert-Jan Marrink, Birgit Schiøtt

Version 1 posted 17 November 2023

849

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2

Citations

Inorganic Chemistry

Towards Frustration in Eu(II) Archimedean Tessellations

Hua Chen, Anna S. Manvell, Mariusz Kubus, Maja A. Dunstan, Giulia Lorusso, David Gracia, Mike S. B. Jørgensen, Søren Kegnæs, Fabrice Wilhelm, Andrei Rogalev, Marco Evangelisti, Kasper S. Pedersen

Version 1 posted 15 November 2022

251

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Inorganic Chemistry

Molecular alloying drives valence change in a van der Waals antiferromagnet

Frédéric Aribot, Laura Voigt, Maja A. Dunstan, Wenjie Wan, James N. McPherson, Mariusz Kubus, Nathan J. Yutronkie, Charles J. McMonagle, Marco Coletta, Anna S. Manvell, Anton Viborg, Siena Wong, Kirstine A. Stampe, Volodymyr Baran, Anatoliy Senyshyn, Manh Duc Le, Helen C. Walker, Amit Chanda, Felix Trier, Nini Pryds, Fabrice Wilhelm, Michael R. Probert, Niels B. Christensen, Euan K. Brechin, Andrei Rogalev, Kasper S. Pedersen

Version 1 posted 22 July 2024

313

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