scholarly journals Evaluating the Intrinsic Cysteine Redox-Dependent States of the A-Chain of Human Insulin Using NMR Spectroscopy, Quantum Chemical Calculations, and Mass Spectrometry

2010 ◽  
Vol 114 (1) ◽  
pp. 585-591 ◽  
Author(s):  
Alok K. Sharma ◽  
Yan Ling ◽  
Allison B. Greer ◽  
David A. Hafler ◽  
Sally C. Kent ◽  
...  
Keyword(s):  
Mass Spectrometry ◽  
Nmr Spectroscopy ◽  
Quantum Chemical Calculations ◽  
Human Insulin ◽  
Quantum Chemical ◽  
A Chain

scholarly journals Argentate(i) and (iii) complexes as intermediates in silver-mediated cross-coupling reactions

2018 ◽  
Vol 54 (40) ◽  
pp. 5086-5089 ◽  
Author(s):  
Sebastian Weske ◽  
Richard A. Hardin ◽  
Thomas Auth ◽  
Richard A. J. O’Hair ◽  
Konrad Koszinowski ◽  
...  
Keyword(s):  
Mass Spectrometry ◽  
Nmr Spectroscopy ◽  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Cross Coupling ◽  
Coupling Reactions ◽  
Cross Coupling Reactions ◽  
Esi Mass Spectrometry

Silver-mediated cross-coupling reactions proceed via anionic ate complexes, which have been characterized by a combination of NMR spectroscopy, ESI mass spectrometry, and quantum-chemical calculations.

scholarly journals The Effect Mechanism of Fe on Coal Pyrolysis to NOx Precursors: Quantum Chemical Calculations and Mass Spectrometry Experiments

ACS Omega ◽  
2020 ◽  
Vol 5 (36) ◽  
pp. 23247-23256
Author(s):  
Ping Chen ◽  
Dongfang Wang ◽  
Mingyan Gu ◽  
Guang Chen ◽  
Xiangyong Huang ◽  
...  
Keyword(s):  
Mass Spectrometry ◽  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Coal Pyrolysis ◽  
Effect Mechanism

Hydrogen-Bonding and the Dissolution Mechanism of Uracil in an Acetate Ionic Liquid: New Insights from NMR Spectroscopy and Quantum Chemical Calculations

2013 ◽  
Vol 117 (15) ◽  
pp. 4109-4120 ◽  
Author(s):  
João M. M. Araújo ◽  
Ana B. Pereiro ◽  
José N. Canongia Lopes ◽  
Luís P. N. Rebelo ◽  
Isabel M. Marrucho
Keyword(s):  
Ionic Liquid ◽  
Hydrogen Bonding ◽  
Nmr Spectroscopy ◽  
Quantum Chemical Calculations ◽  
Quantum Chemical ◽  
Dissolution Mechanism
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