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5 results in Keywords: conformational change

Physical Chemistry

BAR-based Multi-dimensional Nonequilibrium Pulling for Indirect Construction of QM/MM Free Energy Landscapes: Varying the QM Region

Zhaoxi Sun, Zhirong Liu

Version 3 posted 30 March 2021

465

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Inorganic Chemistry

Fully Delocalized Mixed-Valent Cu1.5Cu1.5 Complex: Strong Cu-Cu Interaction and Fast Electron Self-Exchange Rate Despite Large Structural Changes

Yang Liu, Stefan Resch, Haowei Chen, Sebastian Dechert, Serhiy Demeshko, Eckhard Bill, Shengfa Ye, Franc Meyer

Version 1 posted 27 October 2022

249

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Theoretical and Computational Chemistry

The catalytic effects of active site conformational change in the allosteric activation of imidazole glycerol phosphate synthase

Heidi Klem, Juan V. Alegre-Requena, Robert S. Paton

Version 1 posted 16 June 2023

237

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Organic Chemistry

Hypersensitive Inhibition of Organocatalysts by Halide Salts

Teppo Leino, Dimitris Noutsias, Kaisa Helttunen, Jani Moilanen, Eeki Tarkkonen, Elina Kalenius, Anniina Kiesilä, Petri Pihko

Version 2 posted 15 September 2023

264

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Theoretical and Computational Chemistry

Developing Force Fields for Accurate Mg2+ and Triphosphate Interactions in ATP∙Mg2+ Complexes

Fangchen Hu, Yuwei Zhang, Pengfei Li, Ruibo Wu, Fei Xia

Version 1 posted 12 June 2024

151

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