About: Structure, spectra and the effects of twisting of beta-sheet peptides. A density functional theory study

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	The structure, infrared (IR) absorption and vibrational circular dichroism (VCD) spectra and their response to twisting of a model peptide dimer (Ac-Ala3-NHMe)2 in vacuum is calculated with density functional theory (DFT) and compared in terms of twisting energetics The structure, infrared (IR) absorption and vibrational circular dichroism (VCD) spectra and their response to twisting of a model peptide dimer (Ac-Ala3-NHMe)2 in vacuum is calculated with density functional theory (DFT) and compared in terms of twisting energetics (en) Struktura, absorpční a vibrační cirkulárně-dichroická spektra a jejich závislost na geometrii modelového dimeru byla studována na základě kvantových výpočtů (cs)
Title	Structure, spectra and the effects of twisting of beta-sheet peptides. A density functional theory study Struktura, spektra a vliv neplanarity peptidových beta-listů. Studie pomocí teorie elektronové hustoty (cs) Structure, spectra and the effects of twisting of beta-sheet peptides. A density functional theory study (en)
skos:prefLabel	Structure, spectra and the effects of twisting of beta-sheet peptides. A density functional theory study Struktura, spektra a vliv neplanarity peptidových beta-listů. Studie pomocí teorie elektronové hustoty (cs) Structure, spectra and the effects of twisting of beta-sheet peptides. A density functional theory study (en)
skos:notation	RIV/61388963:_____/04:00101978!RIV/2005/GA0/A57005/N
http://linked.open.../vavai/riv/strany	95;105
http://linked.open...avai/riv/aktivita	P Z
http://linked.open...avai/riv/aktivity	P(GA203/01/0031), P(IAA4055104), Z(AV0Z4055905)
http://linked.open...iv/cisloPeriodika	-
http://linked.open...vai/riv/dodaniDat	2005
http://linked.open...aciTvurceVysledku	Bouř, Petr
http://linked.open.../riv/druhVysledku	J - Článek v odborném periodiku
http://linked.open...iv/duvernostUdaju	S - Úplné a pravdivé údaje nepodléhající ochraně podle zvláštních právních předpisů
http://linked.open...titaPredkladatele	Ústav organické chemie a biochemie AV ČR, v. v. i.
http://linked.open...dnocenehoVysledku	588547
http://linked.open...ai/riv/idVysledku	RIV/61388963:_____/04:00101978
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	vibrational circular dichroism; density functional theory; peptide secondary structure (en)
http://linked.open.../riv/klicoveSlovo	vibrational circular dichroism density functional theory peptide secondary structure
http://linked.open...odStatuVydavatele	NL - Nizozemsko
http://linked.open...ontrolniKodProRIV	[FAA089B53E0C]
http://linked.open...i/riv/nazevZdroje	Journal of Molecular Structure: Theochem
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	1 (xsd:int)
http://linked.open...cetTvurcuVysledku	2 (xsd:int)
http://linked.open...vavai/riv/projekt	Experimental and theoretical development of the Raman optical activity as a stereochemical probe for aqueous environment Molecular Structural Studies with Circular-Dichroic and NMR Spectra
http://linked.open...UplatneniVysledku	2004
http://linked.open...v/svazekPeriodika	675
http://linked.open...iv/tvurceVysledku	Bouř, Petr Keiderling, T. A.
http://linked.open...n/vavai/riv/zamer	Chemical principles of selected biological phenomena in medicine and ecology
issn	0166-1280
number of pages	11 (xsd:int)

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