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Statements

Subject Item
n2:RIV%2F61388963%3A_____%2F05%3A00021230%21RIV06-MSM-61388963
rdf:type
n4:Vysledek skos:Concept
dcterms:description
Keto a enol tautomery thyminu a uracilu byly teoreticky studovány v plynné fázi, v mikrohydratovaném prostředí a ve vodném roztoku. Solvatace byla popsána pomocí metod: termodynamická integrace, Conductor-like polarizable continuum model (C-PCM) a hybridního modelu (metoda C-PCM + explicitní molekuly vody). Byla provedena experimentální detekce tautomerů pomocí steady-state fluorescence. Keto and enol tautomers of thymine and uracil were studied theoretically in the gas phase, in a microhydrated environment and in a water environment. Solvation effects were described using the thermodynamic integration method, Conductor-like polarizable continuum model (C-PCM) and hybrid model (C-PCM + explicit water molecules). A short experimental detection of tautomers by means of steady-state fluorescence was also included. Keto and enol tautomers of thymine and uracil were studied theoretically in the gas phase, in a microhydrated environment and in a water environment. Solvation effects were described using the thermodynamic integration method, Conductor-like polarizable continuum model (C-PCM) and hybrid model (C-PCM + explicit water molecules). A short experimental detection of tautomers by means of steady-state fluorescence was also included.
dcterms:title
Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part. 4. Uracil and thymine Báze nukleových kyselin a jejich tautomery v plynné fázi, mikrohydratovaném prostředí a ve vodném roztoku - korelovaná ab initio studie. Část čtvrtá. Uracil a thymin Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part. 4. Uracil and thymine
skos:prefLabel
Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part. 4. Uracil and thymine Correlated ab initio study of nucleic acid bases and their tautomers in the gas phase, in a microhydrated environment and in aqueous solution. Part. 4. Uracil and thymine Báze nukleových kyselin a jejich tautomery v plynné fázi, mikrohydratovaném prostředí a ve vodném roztoku - korelovaná ab initio studie. Část čtvrtá. Uracil a thymin
skos:notation
RIV/61388963:_____/05:00021230!RIV06-MSM-61388963
n5:strany
2006;2017
n5:aktivita
n9:Z n9:P
n5:aktivity
P(GA203/05/0009), P(LC512), Z(AV0Z40550506)
n5:cisloPeriodika
-
n5:dodaniDat
n7:2006
n5:domaciTvurceVysledku
n6:9650199 n6:1890646 n6:1014285 n6:2932016
n5:druhVysledku
n13:J
n5:duvernostUdaju
n8:S
n5:entitaPredkladatele
n17:predkladatel
n5:idSjednocenehoVysledku
516457
n5:idVysledku
RIV/61388963:_____/05:00021230
n5:jazykVysledku
n18:eng
n5:klicovaSlova
nucleic acid bases; tautomers; solvation
n5:klicoveSlovo
n11:solvation n11:nucleic%20acid%20bases n11:tautomers
n5:kodStatuVydavatele
GB - Spojené království Velké Británie a Severního Irska
n5:kontrolniKodProRIV
[3CB814DC5107]
n5:nazevZdroje
Physical Chemistry Chemical Physics
n5:obor
n10:CF
n5:pocetDomacichTvurcuVysledku
4
n5:pocetTvurcuVysledku
5
n5:projekt
n16:GA203%2F05%2F0009 n16:LC512
n5:rokUplatneniVysledku
n7:2005
n5:svazekPeriodika
7
n5:tvurceVysledku
Hobza, Pavel Kabeláč, Martin Rejnek, Jaroslav Ryjáček, Filip Hanus, Michal
n5:zamer
n14:AV0Z40550506
s:issn
1463-9076
s:numberOfPages
12