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4 results in Keywords: 19F NMR spectroscopy

Theoretical and Computational Chemistry

Evaluation of machine learning models for the accelerated prediction of Density Functional Theory calculated 19F chemical shifts based on local atomic environments

Sophia Li, Emma Wang, Leia Pei, Sourodeep Deb, Prashanth Prabhala, Sai Hruday Reddy Nara, Raina Panda, Shiven Eltepu, Marx Akl, Larry McMahan, Edward Njoo

Version 1 posted 31 July 2024

240

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Organic Chemistry

Benchtop 19F nuclear magnetic resonance spectroscopy enabled kinetic studies and optimization of the synthesis of carmofur

Xina Wang, Julia Vu, Charissa Luk, Edward Njoo

Version 1 posted 12 October 2022

368

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1

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Quantitative benchtop 19F NMR spectroscopy: a robust and economical tool for rapid reaction optimization

Gregor Heinrich, Mykhailo Kondratiuk, Lukas J. Gooßen, Mario P. Wiesenfeldt

Version 1 posted 12 April 2023

992

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Biological and Medicinal Chemistry

An Unprecedented Octahedral Trifluoromagnesate MgF3(Wat)– Transition State Analog Reveals The Molecular Mechanism of ATP Hydrolysis by Zika Virus Helicase

Mengyu Ge, Robert W. Molt Jr, Huw T. Jenkins, G. Michael Blackburn, Yi Jin, Alfred A. Antson

Version 1 posted 28 February 2020

734

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