Magnetic Resonance in Chemistry

Article	Citations
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Unlocking the Chemical Diversity of Plant Catharanthus roseus: Nuclear Magnetic Resonance Spectroscopy Approach	23
NMR Spectroscopic Reference Data of Synthetic Cannabinoids Sold on the Internet	18
Nuclear magnetic resonance/magnetic resonance imaging on lubricating greases: Observation of bleeding and aging	17
The use of DOSY experiments to determine the solution structures of coinage metal pyrazolates: The case of {[3,5‐(CF3)2Pz]Ag}3	17
Revisiting the structure of Heliannuol L: A computational approach	16
Quantitative NMR using water as internal calibrant	15
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	15
Non‐uniform sampling to enhance the performance of compact NMR for characterizing new psychoactive substances	15
NMR spectroscopic discrimination of the enantiomer pairs of soman and bispinacolyl‐methylphosphonate and detailed analysis of the pinacolyl group 1H NMR resonances	13
Quantitative Solid‐State NMR Spectroscopy (qSSNMR) in Pharmaceutical Analysis	13
Compositional analysis of multilayered plastic constituents and constituent mixtures using benchtop 1H NMR spectroscopy	13
Determination of the pKa Value of a Brønsted Acid by 19F NMR Spectroscopy	11
A robust t1 noise suppression method in NMR spectroscopy	11
6aH‐Benzo[α]fluorene: NMR evidence of the unexpected product of the reaction of butyryl chloride with 1,2‐diphenylacetylene	11
Contributions towards variable temperature shielding for compact NMR instruments	11
Solid‐State NMR‐Assisted Dynamic Characterization of two Isostructural Solvates of 5α‐Bromo‐6β,19‐Epoxy‐Androstan‐3β,17β‐Diol Diacetate	10
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Intracellular pyruvate–lactate–alanine cycling detected using real‐time nuclear magnetic resonance spectroscopy of live cells and isolated mitochondria	9
A reliable external calibration method for reaction monitoring with benchtop NMR	8
Computational1H and13C NMR in structural and stereochemical studies	8

Dynamic and molecular association in premicellar aqueous solutions of dicarboxylate amino acid‐based surfactant as studied by 1H NMR	8
Liquid‐phase NMR of asphaltenes	8
Revisiting aliasing noise to build more robust sparsity in nonuniform sampling 2D‐NMR	8
Brewing alcohol 101: An undergraduate experiment utilizing benchtop NMR for quantification and process monitoring	8
Determination of self‐diffusion coefficients in mixtures with benchtop 13C NMR spectroscopy via polarization transfer	8
Quantum Chemical NMR Spectroscopic Structural Analysis in Solution: The Investigation of 3‐Indoleacetic Acid Dimer Formation in Chloroform and DMSO Solution	7
Meet the new members of the associate editorial board	7
Prediction of 15N chemical shifts by machine learning	7
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Automated Data Processing Workflows for Non‐Expert Users of NMR Facilities	7
HRMAS NMR for Studying Solvent‐Induced Mobility of Polymer Chains and Metallocene Migration Into Low‐Density Polyethylene (LDPE)	7
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Portable single‐sided NMR measurements at variable temperatures: Implementation of a thermo‐controlled device and application to the heating of bread dough	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
A structural investigation of organic battery anode materials by NMR crystallography	6
Quantitative sodium magnetic resonance imaging in food: Addressing sensitivity issues using single quantum chemical shift imaging at high field	6
Distinguishing between COOH, COO−, and hydrogen disordered COOH sites in solids with 13C chemical shift anisotropy and T1 measurements	6
Quantitative MRI analysis of structural changes in tomato tissues resulting from dehydration	5
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Echo pulses for background suppression by optimal control	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
Molecular precursors to produce para‐hydrogen enhanced metabolites at any field	5
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Evaluation of Automatic Analysis Software for 1H NMR Spectra Quantification. Impact of Signal Broadening and EDTA Addition	5
Computational NMR of charged systems	5
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
Synthesis, isolation and characterisation of fluorinated‐benzimidazoisoquinoline regioisomers	5
Prediction of chemical shift in NMR: A review	5
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A low‐temperature dynamic 1H, 13C, and 77Se NMR study of 2,2′‐selenodicyclohexanol	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
A sulfur‐33 nuclear quadrupole resonance study of 33S2‐labeled L‐cystine	4
Four‐component relativistic calculations of NMR shielding constants of the transition metal complexes. Part 1: Pentaammines of cobalt, rhodium, and iridium	4
Exploring the structure of pure germanophospate glasses with different concentrations probed by magic angle spinning NMR spectroscopy	4
Two New Alkaloids of the Endophytic Fungus Rhizopus oryzae From Atractylodes macrocephala Koidz	4
The efficiency of micellar solubilization of naphthalene from aqueous solutions using rhamnolipid as a biological surfactant according to NMR diffusometry	4
Multinuclear 1H/13C/15N chemical shift assignment of therapeutic octreotide acetate performed at natural abundance	4
Recent advances in liquid‐phase NMR of the coal‐derived products	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
A new amide from the fruiting bodies of Tricholoma bakamatsutake	4
Identification of seven psychedelic 2,5‐dimethoxy‐phenylethyl‐amine‐based designer drugs via benchtop 1H nuclear magnetic resonance spectroscopy	4
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
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Supercritical CO2 impregnation process applied to polymer samples preparation for dynamic nuclear polarization solid‐state NMR	4
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Micellar Solubilization of Phenols With One or Two Hydroxyl Groups Using Biological Surfactant Rhamnolipid	4
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Through‐space H‐F coupling in a series of 4‐substituted‐1H‐1,2,3‐triazoles	4
Tritium NMR: A compilation of data and a practical guide	4
Density functional theory calculations of copper‐doped rutile crystals: Local structural, electronic, optical, and electron paramagnetic resonance properties	4
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NMR and Chemometric Analysis of Verbascoside and Isoverbascoside Produced in Tecoma stans In Vitro Cultures	4
1H and 13C NMR spectra of infinitene and the ring current effect of the aromatic molecule	4
Recent advances in solid‐state nuclear magnetic resonance spectroscopy of quadrupolar nuclei	4
Stereochemical assignment of four monoterpene glucoside derivatives from Turpinia montana Kurz by NMR study combined with CD spectroscopy	4
Computer‐assisted structure elucidation (CASE): Current and future perspectives	3
Simultaneous 15N polarization of several biocompatible substrates in ethanol–water mixtures by signal amplification by reversible exchange (SABRE) method	3
Computational 199Hg NMR	3
Frontiers in NMR metabolomics	3
Potential of multiparametric characterization of foodstuffs by nuclear magnetic resonance to better predict microbial behavior	3
Effects of Processing Methods on the Physical Properties of Aquafaba Powder: Time‐Domain Nuclear Magnetic Resonance Analysis	3
Revisiting the Structure of Cacospongionolide E: An Approach Based on Empirical Rules and NMR Calculations	3
Interpretation of EPR and optical spectra of Ni(II) ions in crystalline lattices at ambient temperature	3
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	3
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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
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Nuclear magnetic resonance‐based structural elucidation of novel marine glycans and derived oligosaccharides	3
Analytical Comparison of Two Quantitative HSQC Methods for the Absolute Quantitation of Metabolites	3
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Charting the solid‐state NMR signals of polysaccharides: A database‐driven roadmap	3
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Solution and solid‐state 33S NMR studies of 33S‐labeled taurine	3
Benchtop/cryofree NMR	3
Anisotropic NMR data acquisition with a prototype 400 MHz cryogen‐free NMR spectrometer	3
Experimental and Computational NMR Studies of Large Alkaloids Exemplified With Vindoline Trimer: Advantages and Limitations	3
Benchmark accuracy of predicted NMR observables for quadrupolar 14N and 17O nuclei in molecular crystals	3
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Analysis of complex mixtures with benchtop nuclear magnetic resonance: Solvent suppression with T2 and diffusion filters	3
The assignment of 11B and 1H resonances in the post‐reaction mixture from the dry synthesis of Li(BH3NH2BH2NH2BH3)	3
You cannot fight the pressure: Structural rearrangements of active pharmaceutical ingredients under magic angle spinning	3
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CAT on MOUSE: Control and automation of temperature for single‐sided NMR instruments such as NMR‐MOUSE	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
Dynamics of eugenol included in β‐cyclodextrin by nuclear magnetic resonance and molecular simulations	3
Temperature lowering of liquid nitrogen via injection of helium gas bubbles improves the generation of parahydrogen‐enriched gas	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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Applicable and cost‐efficient microplastic analysis by quantitative 1H‐NMR spectroscopy using benchtop NMR and NoD methods	2
Investigations on the EPR g factors and local structures for the orthorhombic and tetragonal Cu2+ centers in Pb[Zr0.54Ti0.46]O3	2
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Liquid‐Phase NMR of Humic and Fulvic Acids	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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DFT investigation of coupling constant anomalies in substituted β‐lactams	2
Reaction monitoring via benchtop nuclear magnetic resonance spectroscopy: A practical comparison of on‐line stopped‐flow and continuous‐flow sampling methods	2
The Optical Absorption and Electron Paramagnetic Resonance of Cu2+ Incorporated Dicalcium Lead Propionate	2
Multiscale food structures and foodomics	2
Solid‐state 35/37Cl NMR detection of chlorine atoms directly bound to paramagnetic cobalt(II) ions in powder samples	2
LnDOTA‐d8, a versatile chemical‐shift thermometer for 2H solid‐state NMR	2
Choice of computational protocol for carbon‐lithium spin–spin coupling constants 1JCLi	2
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MagMet: A fully automated web server for targeted nuclear magnetic resonance metabolomics of plasma and serum	2
Quantification of mRNA Using 31P NMR Spectroscopy and CRAFT	2
Structural Elucidation and Complete NMR Spectral Assignments of Monascus Monacolin Analogs	2
Quantitative analysis of selected alkaloids of Mitragyna speciosa using 1H quantitative nuclear magnetic resonance spectroscopy	2
17O nuclear magnetic resonance: Recent advances and applications	2
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A pilot study for fragment identification using 2D NMR and deep learning	2
Stereochemical dependence of substituent γ‐effects in the 19F NMR shielding constants	2
Simple MATLAB and Python scripts for multi‐exponential analysis	2
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An insight into tapioca and wheat starch gelatinization mechanisms using TD‐NMR and complementary techniques	2
Correction to “Revisiting aliasing noise to build more robust sparsity in nonuniform sampling 2D‐NMR”	2
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Structure elucidation of a new lanostane triterpene from Gabonese Ganoderma orbiforme fruiting bodies	2
Theoretical investigations on the defect structures and g factors for V4+ in 30PbO‐5Bi2O3‐(65‐x)SiO2 glasses at different concentrations	2
Erratum: Perspectives of fast magic‐angle spinning 87Rb NMR of organic solids at high magnetic fields	2
Structural elucidation of lactone derivatives from Dendrobium pendulum	1
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Six new iridoid glucosides from Myxopyrum smilacifolium (Wall.) Blume	1
Hyphenation of 2D NMR With Hydrogenative PHIP	1
Calculated and experimental 1H and 13C NMR assignments for cannabicitran	1
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A supramolecular and liquid crystalline water‐based alignment medium based on azobenzene‐substituted 1,3,5‐benzenetricarboxamides	1

Probing Spatial Proximities Between Protons of Collagen Protein in Native Bone Using 2D 1H Multiple Quantum Experiments Under Fast MAS NMR	1
Deciphering molecular structures: NMR spectroscopy and quantum mechanical insights of halogenated 4H‐Chromenediones	1
Automated identification and quantification of metabolites in human fecal extracts by nuclear magnetic resonance spectroscopy	1
Recent advances in the liquid‐phase 6,7Li nuclear magnetic resonance	1
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Investigating the interaction between merocyanine and glutathione through a comprehensive NMR analysis of three GSH‐stabilized merocyanine species	1
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Signal amplification by reversible exchange (SABRE)	1
Position‐Specific Substitution in Cellulose Ethers Studied by DNP Enhanced Solid‐State NMR Spectroscopy	1
On the Use of Strong Proton Donors as a Tool for Overcoming Line Broadening in NMR: A Comment	1
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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
Correction to “A reliable external calibration method for reaction monitoring with benchtop NMR”	1
Proton nuclear magnetic resonance (1H NMR) of flammable organic chemicals in radioactive high‐level supernatant waste at the Savannah River Site (SRS)	1
The NMR added value to the green foodomics perspective: Advances by machine learning to the holistic view on food and nutrition	1
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Aqueous Carbonation of Calcium Silicates With Different Ca/Si Ratios Studied by Solid‐State NMR Spectroscopy	1
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Quantitative at‐line monitoring of enzymatic hydrolysis using benchtop diffusion nuclear magnetic resonance spectroscopy	1
Present and future of pure shift NMR in metabolomics	1
Computational NMR Structural Revision of Marinoaziridines A and B	1
Detecting pore size distribution of activated carbon by low‐field nuclear magnetic resonance	1
NMR characterization of uniformly 13C‐ and/or 15N‐labeled, unsulfated chondroitins with high molecular weights	1
Measuring and modeling anisotropy in the NMR of solids	1
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Computational NMR of natural products: On the way to super large molecules exemplified with alasmontamine A	1
Corrected solid‐state 13C nuclear magnetic resonance peak assignment and side‐group quantification of hydroxypropyl methylcellulose acetyl succinate pharmaceutical excipients	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
PDSFit: PDS data analysis in the presence of orientation selectivity, g‐anisotropy, and exchange coupling	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
SABRE‐enhanced real‐time pure shift NMR spectroscopy	1
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
Solid‐state nuclear magnetic resonance of spin‐9/2 nuclei 115In and 209Bi in functional inorganic complex oxides	1
Nuclear Magnetic Resonance Spectroscopic Characterization and Determination of the New Psychoactive Substance Benzylone: Application in a Biological Fluid	1
Acrylamide derivatives: A dynamic nuclear magnetic resonance study	1
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Evaluation of NMR predictors for accuracy and ability to reveal trends in 1H NMR spectra of fatty acids	0
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Stereochemical assignment of three new benzylisoquinoline alkaloids from Phaeanthus vietnamensis by NMR study combined with CD spectroscopy	0
A theoretical study of the electron paramagnetic resonance spectra and local environment in copper(II) complexes with different imidazole and chlorido ligands	0
Structural Elucidation and NMR Spectral Assignments of New Diphenyl Ether Derivatives From Liuweizhiji Gegen‐Sangshen Oral Liquid	0
Studies on the EPR parameters and local angular distortion for the tetragonal Cu2+ center in CaWO4 crystal	0
Structural elucidation and complete NMR spectral assignments of Monascus monacolin analogues	0
An approach to fast 2D nuclear magnetic resonance at low concentration based on p‐H2‐induced polarization and nonuniform sampling	0
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A Collaborative Study on Platform 1H Quantitative NMR Method Using Internal Calibration Methodology: Towards Capacity Building for Novices	0
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Application of time domain nuclear magnetic resonance (TD‐NMR) for study of the distillation curve of petroleum	0
Al3+ solvation in solutions of aluminum nitrate in a protic ionic liquid: Nuclear magnetic resonance verification of the solvation shell composition	0
Use of carbon‐13 NMR to identify known natural products by querying a nuclear magnetic resonance database—An assessment	0
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
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Application of aromatic amide‐derived atropisomers as chiral solvating agents for discrimination of optically active mandelic acid derivatives in 1H nuclear magnetic resonance spectroscopy	0
RPA(D) and HRPA(D): Calculating NMR Spin–Spin Coupling Constants in Free Amino Acid Residues	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
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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
Overcoming NMR line broadening of nitrogen containing compounds: A simple solution	0
Longitudinal relaxation rate measurements for different signals unveiled by nutation spectroscopy: Application to the characterization of two arrangements experienced by water in a clay network	0
Dual nuclear magnetic resonance for probing intrinsic bone structure and a potential gut–bone axis in ovariectomized rats	0
NMR spectroscopic and theoretical study on the isomerism of dimethyl benzodiazepine(diylidene)diacetates	0
Structure Confirmation of Quinazolinone and Hydroindole Using Residual Dipolar Couplings From Polyarylisocyanide Liquid Crystal	0
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
Optimisation of spatially‐encoded diffusion‐ordered NMR spectroscopy for the analysis of mixtures	0
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Quantitative nuclear magnetic resonance of chloride by an accurate internal standard approach	0
EPR Spectra Hyperfine Structure of Fluorine‐Containing Nitroxide Radicals in Liquid Solutions: Prediction by DFT	0
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Stereoelectronic interactions: A booster for 4JHF transmission	0
Reversibly Compressible Cross‐Linked Polystyrene Gels, Compatible With Toluene‐d8 and Pyridine‐d5, for Measurement of Residual Dipolar Couplings and Residual Chemic	0
Differentiation of patients with and without prostate cancer using urine 1H NMR metabolomics	0
Enhancing Forensic Laboratories Through University Collaboration: Obtaining Conclusive Reports and Reference Materials via NMR	0
A comparable study of the optical spectra and EPR parameters for 3d1‐ and 3d9‐doped MgNH4PO4·6H2O	0
Time domain NMR: An alternative for study of the asphaltenes precipitated in petroleum	0
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Speedy Component Resolution Using Spatially Encoded Diffusion NMR Data	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
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
Carbon‐13 chemical shift tensor measurements for nitrogen‐dense compounds	0
KONSTANTIN L'VOVICH IVANOV	0
19F‐detected dual‐optimized inverted 1JCC 1,n‐ADEQUATE	0