Results 31 to 40 of about 7,476,383 (306)

Solid-state NMR for the characterization of retinal chromophore and Schiff base in TAT rhodopsin embedded in membranes under weakly acidic conditions

open access: yesBiophysics and Physicobiology, 2023
TAT rhodopsin extracted from the marine bacterium SAR11 HIMB114 has a characteristic Thr-Ala-Thr motif and contains both protonated and deprotonated states of Schiff base at physiological pH conditions due to the low pKa.
Sui Arikawa   +6 more
doaj   +1 more source

Interaction Mechanism between Cellobiose and Imidazolium Halide-based Ionic Liquids

open access: yesBioResources, 2023
Ionic liquids (ILs) are excellent solvents for cellulose, but the dissolution mechanism is not deeply understood. In the present study, cellobiose was used as a model of cellulose, and the imidazolium halide-based ILs with the same cation of 1-butyl-3 ...
Ling Yang   +6 more
doaj   +2 more sources

Spectral Data Analysis and Identification of Vancomycin Hydrochloride

open access: yesFrontiers in Chemistry, 2021
Objective: To establish a method for the determination of the chemical structure of vancomycin hydrochloride.Methods: Nuclear magnetic resonance spectroscopy and mass spectrometry were conducted to analyze the chemical structure of vancomycin ...
Ye Tian   +3 more
doaj   +1 more source

Computational and Experimental 1H-NMR Study of Hydrated Mg-Based Minerals

open access: yesMolecules, 2020
Magnesium oxide (MgO) can convert to different magnesium-containing compounds depending on exposure and environmental conditions. Many MgO-based phases contain hydrated species allowing 1H-nuclear magnetic resonance (NMR) spectroscopy to be used in the ...
Eric G. Sorte   +2 more
doaj   +1 more source

NMR chemical shift imaging [PDF]

open access: yesComputerized Medical Imaging and Graphics, 1989
Chemical shift imaging combines the spatial information provided by a conventional nuclear magnetic resonance (NMR) image with the chemical shift spectral information provided by NMR spectroscopy. In order to preserve the chemical shift information and provide a spatial map simultaneously, new NMR imaging methods have been developed.
H F, Brink, M D, Buschmann, B R, Rosen
openaire   +2 more sources

Accurate Prediction of 1H NMR Chemical Shifts of Small Molecules Using Machine Learning

open access: yesMetabolites
NMR is widely considered the gold standard for organic compound structure determination. As such, NMR is routinely used in organic compound identification, drug metabolite characterization, natural product discovery, and the deconvolution of metabolite ...
Tanvir Sajed   +6 more
doaj   +1 more source

Does Chemical Shift Magnetic Resonance Imaging Improve Visualization of Pars Interarticularis Defect?

open access: yesIndian Journal of Radiology and Imaging, 2023
Introduction A unilateral or bilateral pars interarticularis defect (spondylolysis) is a leading cause of axial back pain in adolescent athletes. Currently, a spectrum of imaging modalities is used for assessment of pars interarticularis defects.
Emily Smith   +6 more
doaj   +1 more source

An Organic Chemistry Honors Option Focus on 13C Chemical Shift Studies for Substituted Benzenes and 4-Substitued Pyridines: A Historical and Retrospective View of the Data [PDF]

open access: yes, 2022
The results of a first-year organic chemistry study of 1H and 13C chemical shifts for substituted benzenes and 4-substiuted pyridines is given from a historical perspective.
Madeline, Malfara   +5 more
core   +1 more source

Proton chemical shift and localization in aliphatic open-chain hydrocarbons

open access: yes, 1973
A relationship between proton chemical shift and hybridization at carbon has been established in open-chain alkanes, suggesting that, in these compounds, proton shielding depends miainly on C–H bond ...
LAZZERETTI, Paolo   +2 more
core   +1 more source

PyShifts: A PyMOL Plugin for Chemical Shift-Based Analysis of Biomolecular Ensembles

open access: yes, 2020
Here, we present PyShiftsa PyMOL plugin for chemical shift-based analysis of biomolecular ensembles. With PyShifts, users can compare and visualize differences between experimentally measured and computationally predicted chemical shifts. When analyzing
Aaron T. Frank (1340817)   +5 more
core   +1 more source

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