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5 results in Keywords: noncovalent interaction

Physical Chemistry

Electrostatic Atlas of Noncovalent Interactions Built in Metal-Organic Frameworks

Zhe Ji, Srijit Mukherjee, Jacopo Andreo, Anna Sinelshchikova, Francesca Peccati, Stefan Wuttke, Steven Boxer

Version 1 posted 28 August 2024

391

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1

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Theoretical and Computational Chemistry

Insights into Non-Covalent Interactions with a Machine-Learned Electron Density

Alberto Fabrizio, Andrea Grisafi, Benjamin Meyer, Michele Ceriotti, Clemence Corminboeuf

Version 1 posted 04 June 2019

1,059

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Theoretical and Computational Chemistry

Effect of Mono-Vacant Defects on the Adsorption Properties of Deep Eutectic Solvents onto Hexagonal Boron-Nitride Nanoflakes

Mehdi Shakourian-Fard, S. Maryamdokht Taimoory, Hamid Reza Ghenaatian, Ganesh Kamath, John Trant

Version 1 posted 19 August 2021

355

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Theoretical and Computational Chemistry

Visualization Analysis of Covalent and Noncovalent Interactions in Real Space

Version 1 posted 04 March 2025

194

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Theoretical and Computational Chemistry

Graphically revealing weak interactions in dynamic environments using amIGM method

Version 1 posted 17 February 2025

169

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