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rozprávanie praktický ak quantum chemical nmr calculations of selected illicit drugs pramienok filozof rovnosť

Molecules | Free Full-Text | Modern Approaches in the Discovery and  Development of Plant-Based Natural Products and Their Analogues as  Potential Therapeutic Agents
Molecules | Free Full-Text | Modern Approaches in the Discovery and Development of Plant-Based Natural Products and Their Analogues as Potential Therapeutic Agents

Molecules | Free Full-Text | Factors Governing the Chemical Stability and  NMR Parameters of Uracil Tautomers and Its 5-Halogen Derivatives
Molecules | Free Full-Text | Factors Governing the Chemical Stability and NMR Parameters of Uracil Tautomers and Its 5-Halogen Derivatives

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
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

Rapid characterization of cocaine in illicit drug samples by 1D and 2D NMR  spectroscopy | SpringerLink
Rapid characterization of cocaine in illicit drug samples by 1D and 2D NMR spectroscopy | SpringerLink

Molecular structure and 1 H NMR spectrum (600.13 MHz) of MDMA.HCl in D... |  Download Scientific Diagram
Molecular structure and 1 H NMR spectrum (600.13 MHz) of MDMA.HCl in D... | Download Scientific Diagram

Forensic Drug Analysis Using NMR Spectroscopy
Forensic Drug Analysis Using NMR Spectroscopy

Accurate prediction of terahertz spectra of molecular crystals of fentanyl  and its analogs | Scientific Reports
Accurate prediction of terahertz spectra of molecular crystals of fentanyl and its analogs | Scientific Reports

Benchmark Study on the Calculation of 119Sn NMR Chemical Shifts | Inorganic  Chemistry
Benchmark Study on the Calculation of 119Sn NMR Chemical Shifts | Inorganic Chemistry

NMR spectroscopy: quantum‐chemical calculations - Bühl - 2011 - WIREs  Computational Molecular Science - Wiley Online Library
NMR spectroscopy: quantum‐chemical calculations - Bühl - 2011 - WIREs Computational Molecular Science - Wiley Online Library

Quantum Chemical Calculations of NMR Chemical Shifts in Phosphorylated  Intrinsically Disordered Proteins | Journal of Chemical Theory and  Computation
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…
The application of empirical methods of 13C NMR chemical shift predic…

Non-contact identification and differentiation of illicit drugs using  fluorescent films | Nature Communications
Non-contact identification and differentiation of illicit drugs using fluorescent films | Nature Communications

Quantum Chemical Approaches to the Calculation of NMR Parameters: From  Fundamentals to Recent Advances
Quantum Chemical Approaches to the Calculation of NMR Parameters: From Fundamentals to Recent Advances

Frontiers | Tackling the Problem of Sensing Commonly Abused Drugs Through  Nanomaterials and (Bio)Recognition Approaches
Frontiers | Tackling the Problem of Sensing Commonly Abused Drugs Through Nanomaterials and (Bio)Recognition Approaches

NMR-Based Quantum Mechanical Analysis Builds Trust and Orthogonality in  Structural Analysis: The Case of a Bisdesmosidic Triglycoside as Withania  somnifera Aerial Parts Marker | Journal of Natural Products
NMR-Based Quantum Mechanical Analysis Builds Trust and Orthogonality in Structural Analysis: The Case of a Bisdesmosidic Triglycoside as Withania somnifera Aerial Parts Marker | Journal of Natural Products

NMR spectroscopy: quantum‐chemical calculations - Bühl - 2011 - WIREs  Computational Molecular Science - Wiley Online Library
NMR spectroscopy: quantum‐chemical calculations - Bühl - 2011 - WIREs Computational Molecular Science - Wiley Online Library

Foods | Free Full-Text | Application of 13C Quantitative NMR Spectroscopy  to Isotopic Analyses for Vanillin Authentication Source
Foods | Free Full-Text | Application of 13C Quantitative NMR Spectroscopy to Isotopic Analyses for Vanillin Authentication Source

Quantification of mixtures of analogues of illicit substances by benchtop  NMR spectroscopy - ScienceDirect
Quantification of mixtures of analogues of illicit substances by benchtop NMR spectroscopy - ScienceDirect

Polymorphic Transformation of Drugs Induced by Glycopolymeric Vesicles  Designed for Anticancer Therapy Probed by Solid-State NMR Spectroscopy |  ACS Applied Materials & Interfaces
Polymorphic Transformation of Drugs Induced by Glycopolymeric Vesicles Designed for Anticancer Therapy Probed by Solid-State NMR Spectroscopy | ACS Applied Materials & Interfaces

Quantification of mixtures of analogues of illicit substances by benchtop  NMR spectroscopy - ScienceDirect
Quantification of mixtures of analogues of illicit substances by benchtop NMR spectroscopy - ScienceDirect

1 H quantitative NMR and UHPLC-MS analysis of seized MDMA/NPS mixtures and  tablets from night-club venues - Analytical Methods (RSC Publishing)  DOI:10.1039/C9AY01403A
1 H quantitative NMR and UHPLC-MS analysis of seized MDMA/NPS mixtures and tablets from night-club venues - Analytical Methods (RSC Publishing) DOI:10.1039/C9AY01403A

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
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

13 C solid state NMR spectrum of ephedrine P HCl. | Download Scientific  Diagram
13 C solid state NMR spectrum of ephedrine P HCl. | Download Scientific Diagram

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
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

Molecules | Free Full-Text | Economical Synthesis of 13C-Labeled Opiates,  Cocaine Derivatives and Selected Urinary Metabolites by Derivatization of  the Natural Products
Molecules | Free Full-Text | Economical Synthesis of 13C-Labeled Opiates, Cocaine Derivatives and Selected Urinary Metabolites by Derivatization of the Natural Products

Chromogenic and Fluorogenic Probes for the Detection of Illicit Drugs -  Garrido - 2018 - ChemistryOpen - Wiley Online Library
Chromogenic and Fluorogenic Probes for the Detection of Illicit Drugs - Garrido - 2018 - ChemistryOpen - Wiley Online Library

Synthesis, Molecular Modeling Study, and Quantum-Chemical-Based  Investigations of Isoindoline-1,3-diones as Antimycobacterial Agents | ACS  Omega
Synthesis, Molecular Modeling Study, and Quantum-Chemical-Based Investigations of Isoindoline-1,3-diones as Antimycobacterial Agents | ACS Omega