Theoretical approaches to the calculation of Raman optical activity spectra.
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Importance of solvation in understanding the chiroptical spectra of natural products in solution phase: garcinia acid dimethyl ester.Conformational analyses of peptides and proteins by vibrational Raman optical activity.Calculation of Raman optical activity spectra for vibrational analysis.Recent advances in the use of vibrational chiroptical spectroscopic methods for stereochemical characterization of natural products.Establishing the link between fibril formation and Raman optical activity spectra of insulin.The Raman optical activity of β-D-xylose: where experiment and computation meet.Anharmonic Effects on Vibrational Spectra Intensities: Infrared, Raman, Vibrational Circular Dichroism, and Raman Optical ActivityA single chiroptical spectroscopic method may not be able to establish the absolute configurations of diastereomers: dimethylesters of hibiscus and garcinia acids.Coupled-cluster calculations of vibrational Raman optical activity spectra.Localized optimized orbitals, coupled cluster theory, and chiroptical response properties.The computational prediction of Raman and ROA spectra of charged histidine tautomers in aqueous solution.Vibrational optical activity of chiral carbon nanoclusters treated by a generalized π-electron method.The ab initio calculation of molecular electric, magnetic and geometric properties.Modeling solvent effects on chiroptical propertiesWhere does the Raman optical activity of [Rh(en)3]3+ come from? Insight from a combined experimental and theoretical approach
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P2860
Theoretical approaches to the calculation of Raman optical activity spectra.
description
article científic
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article scientifique
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articolo scientifico
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artigo científico
@pt
bilimsel makale
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scientific article published on January 2009
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vedecký článok
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vetenskaplig artikel
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videnskabelig artikel
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vědecký článek
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name
Theoretical approaches to the calculation of Raman optical activity spectra.
@en
Theoretical approaches to the calculation of Raman optical activity spectra.
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type
label
Theoretical approaches to the calculation of Raman optical activity spectra.
@en
Theoretical approaches to the calculation of Raman optical activity spectra.
@nl
prefLabel
Theoretical approaches to the calculation of Raman optical activity spectra.
@en
Theoretical approaches to the calculation of Raman optical activity spectra.
@nl
P356
P1433
P1476
Theoretical approaches to the calculation of Raman optical activity spectra.
@en
P2093
Andreas J Thorvaldsen
P304
P356
10.1002/CHIR.20777
P478
21 Suppl 1
P50
P577
2009-01-01T00:00:00Z