Magnetic Resonance in Chemistry

Article	Citations
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Issue Information	37
The use of DOSY experiments to determine the solution structures of coinage metal pyrazolates: The case of {[3,5‐(CF3)2Pz]Ag}3	30
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Unlocking the Chemical Diversity of Plant Catharanthus roseus: Nuclear Magnetic Resonance Spectroscopy Approach	22
Revisiting the structure of Heliannuol L: A computational approach	19
Quantitative NMR using water as internal calibrant	16
Nuclear magnetic resonance/magnetic resonance imaging on lubricating greases: Observation of bleeding and aging	15
Probing Pedogenetic Imprints and Functional Properties of Moroccan Clayey Materials Through FFC NMR Relaxometry	13
NMR Spectroscopic Reference Data of Synthetic Cannabinoids Sold on the Internet	13
Effect of the chemical structure of a tetradentate equatorial ligand on the spin‐crossover properties of the Fe (III) complexes chain structures: Electron paramagnetic resonance study	12
Quantitative Solid‐State NMR Spectroscopy (qSSNMR) in Pharmaceutical Analysis	11
Non‐uniform sampling to enhance the performance of compact NMR for characterizing new psychoactive substances	11
Compositional analysis of multilayered plastic constituents and constituent mixtures using benchtop 1H NMR spectroscopy	10
Molecular Basis of UG‐Rich Element Recognition by ESRP2 RRM3	10
Contributions towards variable temperature shielding for compact NMR instruments	9
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NMR spectroscopic discrimination of the enantiomer pairs of soman and bispinacolyl‐methylphosphonate and detailed analysis of the pinacolyl group 1H NMR resonances	9
6aH‐Benzo[α]fluorene: NMR evidence of the unexpected product of the reaction of butyryl chloride with 1,2‐diphenylacetylene	9
An Empirical Equation to Transform 11B GIAO‐Calculated Absolute Shieldings (σ, ppm) in Chemical Shifts (δ, ppm)	9
Intracellular pyruvate–lactate–alanine cycling detected using real‐time nuclear magnetic resonance spectroscopy of live cells and isolated mitochondria	8
Issue Information	8
History of NMR in India	8
Solid‐State NMR‐Assisted Dynamic Characterization of two Isostructural Solvates of 5α‐Bromo‐6β,19‐Epoxy‐Androstan‐3β,17β‐Diol Diacetate	8
Anisotropic NMR Spectroscopy	7

A robust t1 noise suppression method in NMR spectroscopy	7
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Liquid‐phase NMR of asphaltenes	7
Determination of self‐diffusion coefficients in mixtures with benchtop 13C NMR spectroscopy via polarization transfer	7
Dynamic and molecular association in premicellar aqueous solutions of dicarboxylate amino acid‐based surfactant as studied by 1H NMR	7
Computational1H and13C NMR in structural and stereochemical studies	7
Revisiting aliasing noise to build more robust sparsity in nonuniform sampling 2D‐NMR	7
Determination of the pKa Value of a Brønsted Acid by 19F NMR Spectroscopy	7
Automated Data Processing Workflows for Non‐Expert Users of NMR Facilities	7
Brewing alcohol 101: An undergraduate experiment utilizing benchtop NMR for quantification and process monitoring	6
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A structural investigation of organic battery anode materials by NMR crystallography	6
HRMAS NMR for Studying Solvent‐Induced Mobility of Polymer Chains and Metallocene Migration Into Low‐Density Polyethylene (LDPE)	6
A reliable external calibration method for reaction monitoring with benchtop NMR	6
Issue Information	6
Prediction of chemical shift in NMR: A review	6
Meet the new members of the associate editorial board	6
Molecular precursors to produce para‐hydrogen enhanced metabolites at any field	6
Theoretical studies of the concentration dependences of d–d transition band, g factors, and local distortion for V4+ in Li2O–PbO–B2O3–P	6
Distinguishing between COOH, COO−, and hydrogen disordered COOH sites in solids with 13C chemical shift anisotropy and T1 measurements	5
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Quantitative sodium magnetic resonance imaging in food: Addressing sensitivity issues using single quantum chemical shift imaging at high field	5
Echo pulses for background suppression by optimal control	5
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Quantitative MRI analysis of structural changes in tomato tissues resulting from dehydration	5
Portable single‐sided NMR measurements at variable temperatures: Implementation of a thermo‐controlled device and application to the heating of bread dough	5
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Investigation of the surfactant distribution in oil‐in‐water emulsions during the crystallization of the dispersed phase via nuclear magnetic resonance relaxometry and diffusometry	5
A holistic NMR framework to understand environmental impact: Examining the impacts of superparamagnetic iron oxide nanoparticles (SPIONs) in Daphnia magna via imaging, spectroscopy,	5
Two New Alkaloids of the Endophytic Fungus Rhizopus oryzae From Atractylodes macrocephala Koidz	5
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Quantum Chemical NMR Spectroscopic Structural Analysis in Solution: The Investigation of 3‐Indoleacetic Acid Dimer Formation in Chloroform and DMSO Solution	5
Evaluation of Automatic Analysis Software for 1H NMR Spectra Quantification. Impact of Signal Broadening and EDTA Addition	5
Characterization of the sodium binding state in several food products by23Na nuclear magnetic resonance spectroscopy	5
Pure shift FESTA: An ultra‐high resolution NMR tool for the analysis of complex fluorine‐containing spin systems	5
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Low‐field, not low quality: 1D simplification, selective detection, and heteronuclear 2D experiments for improving low‐field NMR spectroscopy of environmental and biological samples	4
1H and 13C NMR spectra of infinitene and the ring current effect of the aromatic molecule	4
Tritium NMR: A compilation of data and a practical guide	4
NMR and Chemometric Analysis of Verbascoside and Isoverbascoside Produced in Tecoma stans In Vitro Cultures	4
NMR Insights Into Stress‐Induced Modulation of the Monomer–Dimer Equilibrium in a Small Heat Shock Protein	4
A sulfur‐33 nuclear quadrupole resonance study of 33S2‐labeled L‐cystine	4
Multinuclear 1H/13C/15N chemical shift assignment of therapeutic octreotide acetate performed at natural abundance	4
DOSY NMR Experiments at Variable Temperature. A Thorough Analysis of Optimal Conditions for Reliable Results	4
Supercritical CO2 impregnation process applied to polymer samples preparation for dynamic nuclear polarization solid‐state NMR	4
Four‐component relativistic calculations of NMR shielding constants of the transition metal complexes. Part 1: Pentaammines of cobalt, rhodium, and iridium	4
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Micellar Solubilization of Phenols With One or Two Hydroxyl Groups Using Biological Surfactant Rhamnolipid	4
Benchtop nuclear magnetic resonance performance evaluation according to ASTM E691–22 on a population of instruments: Molar substitution determination in hydroxypropyl betadex as a case study for use i	4

Stereochemical assignment of four monoterpene glucoside derivatives from Turpinia montana Kurz by NMR study combined with CD spectroscopy	4
The efficiency of micellar solubilization of naphthalene from aqueous solutions using rhamnolipid as a biological surfactant according to NMR diffusometry	4
Exploring the structure of pure germanophospate glasses with different concentrations probed by magic angle spinning NMR spectroscopy	4
Through‐space H‐F coupling in a series of 4‐substituted‐1H‐1,2,3‐triazoles	4
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Recent advances in liquid‐phase NMR of the coal‐derived products	4
A new amide from the fruiting bodies of Tricholoma bakamatsutake	4
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Revisiting the Structure of Cacospongionolide E: An Approach Based on Empirical Rules and NMR Calculations	3
Evaluation of double‐tuned single‐sided planar microcoils for the analysis of small 13C enriched biological samples using 1H‐13C 2D heteronuclear correlation NMR spect	3
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Frontiers in NMR metabolomics	3
The Mechanism of [IrCl6]2− Complex Transformation in Acetone Solutions Studied by EPR and UV–Vis Spectroscopy	3
Computational 199Hg NMR	3
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Metabolic Reprogramming in Pheochromocytoma and Paraganglioma: Insights From Untargeted NMR Metabolomics Presurgical and Postsurgical intervention	3
Charting the solid‐state NMR signals of polysaccharides: A database‐driven roadmap	3
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Nuclear magnetic resonance‐based structural elucidation of novel marine glycans and derived oligosaccharides	3
Differentiation of regioisomeric N‐alkylation of some indazoles and pyrazolopyridines by advanced NMR techniques	3
Structure Elucidation of New Kavalactone Dimers From Alpinia zerumbet Pericarps Using NMR Calculations	3
Benchmark accuracy of predicted NMR observables for quadrupolar 14N and 17O nuclei in molecular crystals	3
Analytical Comparison of Two Quantitative HSQC Methods for the Absolute Quantitation of Metabolites	3
Solution and solid‐state 33S NMR studies of 33S‐labeled taurine	3
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Effects of Processing Methods on the Physical Properties of Aquafaba Powder: Time‐Domain Nuclear Magnetic Resonance Analysis	3
Tutorial: Saturation Transfer Difference NMR for Studying Small Molecules Interacting With Nanoparticles	3
Unexpected structural/motional mode of water intercalated into an α‐crystalline zirconium phosphate deduced by 31P and 2H solid‐state MAS NMR spectra	3
The assignment of 11B and 1H resonances in the post‐reaction mixture from the dry synthesis of Li(BH3NH2BH2NH2BH3)	3
Interpretation of EPR and optical spectra of Ni(II) ions in crystalline lattices at ambient temperature	3
Analysis of complex mixtures with benchtop nuclear magnetic resonance: Solvent suppression with T2 and diffusion filters	3
You cannot fight the pressure: Structural rearrangements of active pharmaceutical ingredients under magic angle spinning	3
CAT on MOUSE: Control and automation of temperature for single‐sided NMR instruments such as NMR‐MOUSE	3
Potential of multiparametric characterization of foodstuffs by nuclear magnetic resonance to better predict microbial behavior	3
Solid‐state 35/37Cl NMR detection of chlorine atoms directly bound to paramagnetic cobalt(II) ions in powder samples	2
Aqueous Carbonation of Calcium Silicates With Different Ca/Si Ratios Studied by Solid‐State NMR Spectroscopy	2
17O nuclear magnetic resonance: Recent advances and applications	2
The Optical Absorption and Electron Paramagnetic Resonance of Cu2+ Incorporated Dicalcium Lead Propionate	2
Theoretical investigations on the defect structures and g factors for V4+ in 30PbO‐5Bi2O3‐(65‐x)SiO2 glasses at different concentrations	2
Correction to “Revisiting aliasing noise to build more robust sparsity in nonuniform sampling 2D‐NMR”	2
Anisotropic NMR data acquisition with a prototype 400 MHz cryogen‐free NMR spectrometer	2
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LnDOTA‐d8, a versatile chemical‐shift thermometer for 2H solid‐state NMR	2
Experimental and Computational NMR Studies of Large Alkaloids Exemplified With Vindoline Trimer: Advantages and Limitations	2
Dynamics of eugenol included in β‐cyclodextrin by nuclear magnetic resonance and molecular simulations	2
Investigations on the EPR g factors and local structures for the orthorhombic and tetragonal Cu2+ centers in Pb[Zr0.54Ti0.46]O3	2
Multiscale food structures and foodomics	2
MagMet: A fully automated web server for targeted nuclear magnetic resonance metabolomics of plasma and serum	2
Reaction monitoring via benchtop nuclear magnetic resonance spectroscopy: A practical comparison of on‐line stopped‐flow and continuous‐flow sampling methods	2
Quantification of mRNA Using 31P NMR Spectroscopy and CRAFT	2
Theoretical Studies on the EPR Parameters and Local Structures for the Orthorhombic and Tetragonal Cu2+ Centers in Cu1−xHxZr2(PO4)<	2
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Choice of computational protocol for carbon‐lithium spin–spin coupling constants 1JCLi	2
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HSQC/F1‐PSYCHE TOCSY NOAH Supersequence for High‐Resolution NMR Analysis of Urine Metabolites	2
Liquid‐Phase NMR of Humic and Fulvic Acids	2
Temperature lowering of liquid nitrogen via injection of helium gas bubbles improves the generation of parahydrogen‐enriched gas	2
Simple MATLAB and Python scripts for multi‐exponential analysis	2
Stereochemical dependence of substituent γ‐effects in the 19F NMR shielding constants	2
Quantitative analysis of selected alkaloids of Mitragyna speciosa using 1H quantitative nuclear magnetic resonance spectroscopy	2
Curvulomycin E, a New Resorcylic Acid Lactone From the Beibu Gulf Coral‐Derived Fungus Curvularia lunata GXIMD 02512	2
Synthesis and Evidence for the Stereo/Region‐Specific Structure of 5,7‐Di(het)aryl‐4,5,6,7‐tetrahydro‐6‐nitroazolo[1,5‐a]pyrimidines	2
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DFT investigation of coupling constant anomalies in substituted β‐lactams	2
An insight into tapioca and wheat starch gelatinization mechanisms using TD‐NMR and complementary techniques	2
NMR‐Based Clinical Metabolomics Reveals Distinctive Metabolic Signatures in Systemic Sclerosis and Systemic Lupus Erythematosus	2
Methyl α‐D‐galactopyranosyl‐(1→3)‐β‐D‐galactopyranoside and methyl β‐D‐galactopyranosyl‐(1→3)‐β‐D‐galactopyranoside: Glycosidic linkage conformation determined from MA'AT analysis	2
Benchtop/cryofree NMR	2
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Structuring the GPCR Story Through the Lens of NMR	1
Local Structure and Optical Absorption of Mn2+ Intoxicated YPO4 Single Crystals	1
Spatially Resolved 13C NMR Spectroscopy in Bimesophasic Samples Applied to Molecular Analysis in Orienting Media	1
Dynamic NMR Simulations: A Case Study of Solution‐State CPMG‐RD and CEST Experiments	1
On the Use of Strong Proton Donors as a Tool for Overcoming Line Broadening in NMR: A Comment	1
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PDSFit: PDS data analysis in the presence of orientation selectivity, g‐anisotropy, and exchange coupling	1
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Monitoring Protein Deamidation in Real Time Using NMR	1
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The NMR added value to the green foodomics perspective: Advances by machine learning to the holistic view on food and nutrition	1

Hyphenation of 2D NMR With Hydrogenative PHIP	1
Proton nuclear magnetic resonance (1H NMR) of flammable organic chemicals in radioactive high‐level supernatant waste at the Savannah River Site (SRS)	1
Structural Elucidation and Complete NMR Spectral Assignments of Monascus Monacolin Analogs	1
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Sensitivity of Projections of Backbone 13Cα/15N Chemical Shielding Along Covalent Bonds to Protein Secondary Structure—An Ab Initio Study	1
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Understanding the Interactions of Nanoparticles and Dissolved Organic Matter at the Molecular Level by 1H 2D Multi‐Exponential Transverse Relaxation NMR Spectroscopy	1
Automated identification and quantification of metabolites in human fecal extracts by nuclear magnetic resonance spectroscopy	1
Detecting pore size distribution of activated carbon by low‐field nuclear magnetic resonance	1
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NMR characterization of uniformly 13C‐ and/or 15N‐labeled, unsulfated chondroitins with high molecular weights	1
Acrylamide derivatives: A dynamic nuclear magnetic resonance study	1
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Corrected solid‐state 13C nuclear magnetic resonance peak assignment and side‐group quantification of hydroxypropyl methylcellulose acetyl succinate pharmaceutical excipients	1
Signal amplification by reversible exchange (SABRE)	1
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Cover Picture	1
Investigating the interaction between merocyanine and glutathione through a comprehensive NMR analysis of three GSH‐stabilized merocyanine species	1
Structural elucidation of lactone derivatives from Dendrobium pendulum	1
Probing Spatial Proximities Between Protons of Collagen Protein in Native Bone Using 2D 1H Multiple Quantum Experiments Under Fast MAS NMR	1
Quantitative at‐line monitoring of enzymatic hydrolysis using benchtop diffusion nuclear magnetic resonance spectroscopy	1
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Deciphering molecular structures: NMR spectroscopy and quantum mechanical insights of halogenated 4H‐Chromenediones	1
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Predicting 51V nuclear magnetic resonance observables in molecular crystals	1
Permethylation as a strategy for high‐molecular‐weight polysaccharide structure analysis by nuclear magnetic resonance—Case study of Xylella fastidiosa extracellular polysaccharide	1
Elucidating structure and dynamics of crystalline α‐zirconium phosphates intercalated with water and methanol by multinuclear solid‐state MAS NMR: A comprehensive NMR approach	1
Continuous‐Wave (CW) Photo‐CIDNP NMR Spectroscopy: A Tutorial	1
Calculated and experimental 1H and 13C NMR assignments for cannabicitran	1
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Correction to “A reliable external calibration method for reaction monitoring with benchtop NMR”	1
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Position‐Specific Substitution in Cellulose Ethers Studied by DNP Enhanced Solid‐State NMR Spectroscopy	1
Computational NMR of natural products: On the way to super large molecules exemplified with alasmontamine A	1
Computational NMR Structural Revision of Marinoaziridines A and B	1
Measuring and modeling anisotropy in the NMR of solids	1
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To flame‐seal or not to flame‐seal NMR tubes: The role of liquid–vapor equilibria on the accuracy of variable temperature experiments	1
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On the geometry dependence of the nuclear magnetic resonance chemical shift of mercury in thiolate complexes: A relativistic density functional theory study	1
Nuclear Magnetic Resonance Spectroscopic Characterization and Determination of the New Psychoactive Substance Benzylone: Application in a Biological Fluid	1
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A supramolecular and liquid crystalline water‐based alignment medium based on azobenzene‐substituted 1,3,5‐benzenetricarboxamides	1
Present and future of pure shift NMR in metabolomics	1
Recent advances in the liquid‐phase 6,7Li nuclear magnetic resonance	1
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Clean Selective Refocusing Sequences With Sensitivity and Resolution Enhancement—A Review	0
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Structure Confirmation of Quinazolinone and Hydroindole Using Residual Dipolar Couplings From Polyarylisocyanide Liquid Crystal	0
The Solvatomagnetism of ET(33) Betaine and of Its Phenolic Precursor	0
Development of a method to determine the SFC in the fat phase of emulsions using TD‐NMR FID‐CPMG deconvolution	0
Speedy Component Resolution Using Spatially Encoded Diffusion NMR Data	0
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Water Molecular Dynamics During Dough Heating by Fast Field Cycling Nuclear Magnetic Resonance	0
Overcoming NMR line broadening of nitrogen containing compounds: A simple solution	0
Heteronuclear Two‐Dimensional NMR for Quantification of Candesartan Cilexetil	0
Spectral Density Function Analysis Reveals Coupled Relaxation and Resonance Modes in Fluorinated Elastomers: Comparison With Semicrystalline Poly(tetrafluoroethylene)	0
Simple and Effective Identification of Local 6π‐ and Global [4n + 2] Aromaticity of Macrocyclic Conjugated Hydrocarbons by 1H/13C Chemical Shifts and the Correspond	0
Are the Structural Analogues and Charged Homologues of Carbones Pseudoallenes (R2C=C=CR2), Pseudocarbenes (R2C–C:−=C+R2) or Pseudocarb	0
A theoretical study of the electron paramagnetic resonance spectra and local environment in copper(II) complexes with different imidazole and chlorido ligands	0
Ambient temperature 1H/13C NMR spectra of sodium 3‐(trimethylsilyl)propane‐1‐sulfonate (DSS) in D2O referenced to external TMS: A discussion of these and closely relat	0
EPR Spectra Hyperfine Structure of Fluorine‐Containing Nitroxide Radicals in Liquid Solutions: Prediction by DFT	0
Dual nuclear magnetic resonance for probing intrinsic bone structure and a potential gut–bone axis in ovariectomized rats	0
Application of time domain nuclear magnetic resonance (TD‐NMR) for study of the distillation curve of petroleum	0
Structure Elucidation of a Regioisomer and Another Proton‐Deficient Breitfussin Analogue Using Anisotropic NMR	0
Carbon‐13 chemical shift tensor measurements for nitrogen‐dense compounds	0
Supporting the assignment of NMR spectra with variable‐temperature experiments	0
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NMR characterization of streptogramin B and L‐156,587, a non‐synergistic pair of the streptogramin family antibiotic complexes produced inductively by a combined culture of Streptomyces albogr	0
Enhancing Forensic Laboratories Through University Collaboration: Obtaining Conclusive Reports and Reference Materials via NMR	0
3D‐Printed Device for Efficient Packing of Semisolid Samples in 3.2‐mm Rotors Used in Cryoprobe Systems	0
Exploring Dysregulated Plasma Metabolites in Sickle‐Cell Disease Patients Using Comparative NMR‐Based Metabolomics	0
Al3+ solvation in solutions of aluminum nitrate in a protic ionic liquid: Nuclear magnetic resonance verification of the solvation shell composition	0
19F‐detected dual‐optimized inverted 1JCC 1,n‐ADEQUATE	0
KONSTANTIN L'VOVICH IVANOV	0
A Collaborative Study on Platform 1H Quantitative NMR Method Using Internal Calibration Methodology: Towards Capacity Building for Novices	0
Quantitative nuclear magnetic resonance of chloride by an accurate internal standard approach	0
13C NMR Studies and Orientational Order of Mesogens With Thiophene and Dimethylamino in Terminal Position	0
Studying the interaction of glycans with intact virions and virus‐like particles by ligand‐observed NMR spectroscopy	0
Use of carbon‐13 NMR to identify known natural products by querying a nuclear magnetic resonance database—An assessment	0
Can simple ‘molecular’ corrections outperform projector augmented‐wave density functional theory in the prediction of 35Cl electric field gradient tensor parameters for chlorine‐containing	0
A Magnetic Resonance Study of Temperature Responsive Volume Phase Transition in a Hydrogel and Its Concurrent Release of Drug Carrier Molecules	0
Computational studies of [1]benzothieno[2,3‐c]naphtho[1,2‐f]quinoline	0
Evaluation of NMR predictors for accuracy and ability to reveal trends in 1H NMR spectra of fatty acids	0
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Structural elucidation and complete NMR spectral assignments of Monascus monacolin analogues	0
Time domain NMR: An alternative for study of the asphaltenes precipitated in petroleum	0
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Extracting Scalar Couplings From Complex 1H NMR Spectra Using a Simple 2D J‐Resolved Sequence	0
Fluorine spin–spin coupling constants of pentafluorobenzene revisited at the ab initio correlated levels	0
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Mapping of 1H NMR chemical shifts relationship with chemical similarities for the acceleration of metabolic profiling: Application on blood products	0