Arrangement of Fibril Side Chains Studied by Molecular Dynamics and Simulated Infrared and Vibrational Circular Dichroism Spectra

2014 ◽  
Vol 118 (24) ◽  
pp. 6937-6945 ◽  
Author(s):  
Jiří Kessler ◽  
Timothy A. Keiderling ◽  
Petr Bouř
Keyword(s):  
Molecular Dynamics ◽  
Circular Dichroism ◽  
Vibrational Circular Dichroism ◽  
Side Chains ◽  
Circular Dichroism Spectra ◽  
Circular Dichroïsm

scholarly journals Natural and magnetic circular dichroism spectra of nucleosides: effect of the dynamics and environment

RSC Advances ◽  
2021 ◽  
Vol 11 (14) ◽  
pp. 8411-8419
Author(s):  
Jakub Kaminský ◽  
Valery Andrushchenko ◽  
Petr Bouř
Keyword(s):  
Molecular Dynamics ◽  
Circular Dichroism ◽  
Nucleic Acids ◽  
Electronic Absorption ◽  
Magnetic Circular Dichroism ◽  
Circular Dichroism Spectra ◽  
Circular Dichroïsm ◽  
Magnetic Circular Dichroism Spectra

Electronic absorption, natural and magnetic circular dichroism spectra of several nucleosides are simulated to understand their dependence on molecular dynamics and environment, their sensitivity to nucleoside pairing and stacking in nucleic acids.

Molecular Structure of Guanine-Quartet Supramolecular Assemblies in a Gel-State Based on a DFT Calculation of Infrared and Vibrational Circular Dichroism Spectra

Langmuir ◽  
2008 ◽  
Vol 24 (14) ◽  
pp. 7520-7527 ◽  
Author(s):  
Vladimír Setnička ◽  
Jakub Nový ◽  
Stanislav Böhm ◽  
Nampally Sreenivasachary ◽  
Marie Urbanová ◽  
...  
Keyword(s):  
Molecular Structure ◽  
Circular Dichroism ◽  
Dft Calculation ◽  
Supramolecular Assemblies ◽  
Vibrational Circular Dichroism ◽  
Circular Dichroism Spectra ◽  
Guanine Quartet ◽  
Circular Dichroïsm

Stereoselective interactions as manifested by vibrational circular dichroism spectra: the interplay between chiral metal complexes co-adsorbed in a montmorillonite clay

2018 ◽  
Vol 20 (39) ◽  
pp. 25421-25427 ◽  
Author(s):  
Hisako Sato ◽  
Kazuyoshi Takimoto ◽  
Hirotoshi Mori ◽  
Akihiko Yamagishi
Keyword(s):  
Circular Dichroism ◽  
Solid State ◽  
Metal Complexes ◽  
Montmorillonite Clay ◽  
Vibrational Circular Dichroism ◽  
Circular Dichroism Spectra ◽  
Circular Dichroïsm

Solid state VCD is applied for intercalated metal complexes.

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