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Predicting Barrier Reduction and Fluorescence with MEP

Predicting Barrier Reduction and Fluorescence with MEP

Anjali B

40,62 €
IVA incluido
Disponible
Editorial:
Draft2Digital
Año de edición:
2024
Materia
Química
ISBN:
9798224675975
40,62 €
IVA incluido
Disponible
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'Predicting Barrier Reduction and Fluorescence with MEP' is a comprehensive book written by Anjali B, which presents the latest advancements in the field of quantum and computational chemistry. The book discusses the role of Molecular Electrostatic Potential (MEP) in predicting barrier reduction and fluorescence in molecules. The book aims to provide a comprehensive understanding of the theoretical and computational methods that can be used to predict these properties in various molecules.The book covers a broad range of topics related to quantum and computational chemistry, including Density Functional Theory (DFT), Electronic Structure, Molecular Orbitals, Chemical Reactivity, Reaction Mechanisms, Organic Chemistry, Inorganic Chemistry, Physical Chemistry, Chemical Synthesis, Chemical Bonding, Molecular Dynamics, Molecular Modeling, Force Fields, Molecular Recognition, Drug Design, Protein-Ligand Interactions, Bioinformatics, Enzymatic Catalysis, Material Science, Nanotechnology, Surface Science, Spectroscopy, NMR, IR, UV-Vis, Raman, X-ray Crystallography, Mass Spectrometry, Chemometrics, Machine Learning, Artificial Intelligence, Big Data Analytics, Statistical Analysis, High-Performance Computing, Quantum Computing, and Scientific Visualization.The book is an excellent resource for students, researchers, and professionals in the field of chemistry who are interested in using computational methods to predict the properties of molecules. The book provides an in-depth understanding of the theoretical and computational techniques used in predicting barrier reduction and fluorescence in molecules, and it is an essential reference for anyone interested in this field. The book also discusses the practical applications of these methods in drug design, material science, and other fields, making it an indispensable resource for researchers in these areas. Overall, 'Predicting Barrier Reduction and Fluorescence with MEP' is a highly informative and useful book that provides a comprehensive overview of the current state of the art in the field of quantum and computational chemistry.

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