About: Normal modes and the Duschinsky mixing of the ground- and excited-state vibrations of the green fluorescent protein chromophore

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About: Normal modes and the Duschinsky mixing of the ground- and excited-state vibrations of the green fluorescent protein chromophore Goto Sponge NotDistinct Permalink

An Entity of Type : http://linked.opendata.cz/ontology/domain/vavai/Vysledek, within Data Space : linked.opendata.cz associated with source document(s)

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rdf:type	skos:Concept http://linked.opendata.cz/ontology/domain/vavai/Vysledek
Description	Ground-and excited-state vibrational frequencies were calculated for the chromophore of the green fluorescent protein (GFP) using the complete active space self-consistent field (CASSCF) method and detailed normal-mode analyses were carried out for ground and excited states. The mixing of the vibrational modes between the different states was studied by applying the Duschinsky effect by the expressing excited-state normal modes in terms of the ground-state normal modes. It was found that the low-frequency vibrational modes in the vertical excited state play a significant role in structural adjustment. Ground-and excited-state vibrational frequencies were calculated for the chromophore of the green fluorescent protein (GFP) using the complete active space self-consistent field (CASSCF) method and detailed normal-mode analyses were carried out for ground and excited states. The mixing of the vibrational modes between the different states was studied by applying the Duschinsky effect by the expressing excited-state normal modes in terms of the ground-state normal modes. It was found that the low-frequency vibrational modes in the vertical excited state play a significant role in structural adjustment. (en)
Title	Normal modes and the Duschinsky mixing of the ground- and excited-state vibrations of the green fluorescent protein chromophore Normal modes and the Duschinsky mixing of the ground- and excited-state vibrations of the green fluorescent protein chromophore (en)
skos:prefLabel	Normal modes and the Duschinsky mixing of the ground- and excited-state vibrations of the green fluorescent protein chromophore Normal modes and the Duschinsky mixing of the ground- and excited-state vibrations of the green fluorescent protein chromophore (en)
skos:notation	RIV/61388963:_____/13:00399792!RIV14-GA0-61388963
http://linked.open...avai/riv/aktivita	I P
http://linked.open...avai/riv/aktivity	I, P(GBP208/12/G016)
http://linked.open...iv/cisloPeriodika	NOV 5
http://linked.open...vai/riv/dodaniDat	2014
http://linked.open...aciTvurceVysledku	Gnanasekaran, Ramachandran
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	92034
http://linked.open...ai/riv/idVysledku	RIV/61388963:_____/13:00399792
http://linked.open...riv/jazykVysledku	eng - angličtina
http://linked.open.../riv/klicovaSlova	proton-transfer; gas-phase; GFP (en)
http://linked.open.../riv/klicoveSlovo	proton-transfer GFP gas-phase
http://linked.open...odStatuVydavatele	NL - Nizozemsko
http://linked.open...ontrolniKodProRIV	[579625FFC95D]
http://linked.open...i/riv/nazevZdroje	Chemical Physics Letters
http://linked.open...in/vavai/riv/obor	CF
http://linked.open...ichTvurcuVysledku	1 (xsd:int)
http://linked.open...cetTvurcuVysledku	1 (xsd:int)
http://linked.open...vavai/riv/projekt	Controlling structure and function of biomolecules at the molecular scale: theory meets experiment
http://linked.open...UplatneniVysledku	2013
http://linked.open...v/svazekPeriodika	587
http://linked.open...iv/tvurceVysledku	Gnanasekaran, Ramachandran
http://linked.open...ain/vavai/riv/wos	000326104500012
issn	0009-2614
number of pages	7 (xsd:int)
http://bibframe.org/vocab/doi	10.1016/j.cplett.2013.09.040

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