Magnetochemistry | Free Full-Text | Quantitative NMR as a Versatile Tool for the Reference Material Preparation
Synthesis, Molecular Modeling Study, and Quantum-Chemical-Based Investigations of Isoindoline-1,3-diones as Antimycobacterial Agents | ACS Omega
An initial investigation of accuracy required for the identification of small molecules in complex samples using quantum chemical calculated NMR chemical shifts | Journal of Cheminformatics | Full Text
Molecules | Free Full-Text | Factors Governing the Chemical Stability and NMR Parameters of Uracil Tautomers and Its 5-Halogen Derivatives
Magnetochemistry | Free Full-Text | The Study of Structural Features of N- and O-Derivatives of 4,5-Dihydroxyimidazolidine-2-Thione by NMR Spectroscopy and Quantum Chemical Calculations
An initial investigation of accuracy required for the identification of small molecules in complex samples using quantum chemical calculated NMR chemical shifts | Journal of Cheminformatics | Full Text
De Novo Determination of the Crystal Structure of a Large Drug Molecule by Crystal Structure Prediction-Based Powder NMR Crystallography | Journal of the American Chemical Society
Quantum-Chemical Simulation of 1H NMR Spectra. 2. Comparison of DFT-Based Procedures for Computing Proton–Proton Coupling Constants in Organic Molecules | The Journal of Organic Chemistry
Quantum Chemical Approaches to the Calculation of NMR Parameters: From Fundamentals to Recent Advances
The 80 MHz ¹H NMR spectra of water and codeine. | Download Scientific Diagram
NMR spectroscopy: quantum‐chemical calculations - Bühl - 2011 - WIREs Computational Molecular Science - Wiley Online Library
Non-contact identification and differentiation of illicit drugs using fluorescent films | Nature Communications
Quantification of mixtures of analogues of illicit substances by benchtop NMR spectroscopy - ScienceDirect
Accurate prediction of terahertz spectra of molecular crystals of fentanyl and its analogs | Scientific Reports
Evolution of Quantitative Measures in NMR: Quantum Mechanical qHNMR Advances Chemical Standardization of a Red Clover (Trifolium pratense) Extract | Journal of Natural Products
Rapid characterization of cocaine in illicit drug samples by 1D and 2D NMR spectroscopy | SpringerLink
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Forensic Drug Analysis Using NMR Spectroscopy
Quantum Chemical Calculations of NMR Chemical Shifts in Phosphorylated Intrinsically Disordered Proteins | Journal of Chemical Theory and Computation
The application of empirical methods of 13C NMR chemical shift predic…
Molecules | Free Full-Text | Modern Approaches in the Discovery and Development of Plant-Based Natural Products and Their Analogues as Potential Therapeutic Agents
13 C solid state NMR spectrum of ephedrine P HCl. | Download Scientific Diagram
Protein conformational flexibility modulates kinetics and thermodynamics of drug binding | Nature Communications
NMR spectroscopy: quantum‐chemical calculations - Bühl - 2011 - WIREs Computational Molecular Science - Wiley Online Library
Structural characterisation of natural products by means of quantum chemical calculations of NMR parameters: new insights - Organic Chemistry Frontiers (RSC Publishing) DOI:10.1039/D1QO00034A
Quantification of mixtures of analogues of illicit substances by benchtop NMR spectroscopy - ScienceDirect
