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Statements

Subject Item
n2:RIV%2F61389013%3A_____%2F08%3A00309608%21RIV10-AV0-61389013
rdf:type
n6:Vysledek skos:Concept
dcterms:description
The intrinsic contributions to the stabilization of imidazopyridopyrimidine-containing DNA duplexes, which are new, promising unnatural DNA motifs, were discussed. The MP2/6-31G*(0.25) interaction energies for the optimal HF/6-31G** hydrogen-bonding arrangements of the complexes between the respective imidazopyridopyrimidine derivatives and guanine covered the range from –60.0 to –101.7 kJ/mol. The MP2/6-31G*(0.25) stacking energies were investigated for a variety of vertical and angular orientations. For some of them, the stacking interaction was found to be competitive to the hydrogen-bonding. The intrinsic contributions to the stabilization of imidazopyridopyrimidine-containing DNA duplexes, which are new, promising unnatural DNA motifs, were discussed. The MP2/6-31G*(0.25) interaction energies for the optimal HF/6-31G** hydrogen-bonding arrangements of the complexes between the respective imidazopyridopyrimidine derivatives and guanine covered the range from –60.0 to –101.7 kJ/mol. The MP2/6-31G*(0.25) stacking energies were investigated for a variety of vertical and angular orientations. For some of them, the stacking interaction was found to be competitive to the hydrogen-bonding.
dcterms:title
Theoretical studies of interactions between imidazopyridopyrimidines and guanine Theoretical studies of interactions between imidazopyridopyrimidines and guanine
skos:prefLabel
Theoretical studies of interactions between imidazopyridopyrimidines and guanine Theoretical studies of interactions between imidazopyridopyrimidines and guanine
skos:notation
RIV/61389013:_____/08:00309608!RIV10-AV0-61389013
n3:aktivita
n21:Z n21:P
n3:aktivity
P(KJB400500602), Z(AV0Z40500505)
n3:dodaniDat
n5:2010
n3:domaciTvurceVysledku
n14:7106831
n3:druhVysledku
n13:D
n3:duvernostUdaju
n20:S
n3:entitaPredkladatele
n9:predkladatel
n3:idSjednocenehoVysledku
399826
n3:idVysledku
RIV/61389013:_____/08:00309608
n3:jazykVysledku
n7:eng
n3:klicovaSlova
DNA; nucleobase; hydrogen-bonding
n3:klicoveSlovo
n10:hydrogen-bonding n10:nucleobase n10:DNA
n3:kontrolniKodProRIV
[55F27B973A08]
n3:mistoKonaniAkce
Bucharest
n3:mistoVydani
Bucharest
n3:nazevZdroje
Mathematics and Computers in Biology and Chemistry. Book Series: Recent Advances in Biology and Biomedicine
n3:obor
n18:CD
n3:pocetDomacichTvurcuVysledku
1
n3:pocetTvurcuVysledku
1
n3:projekt
n19:KJB400500602
n3:rokUplatneniVysledku
n5:2008
n3:tvurceVysledku
Czernek, Jiří
n3:typAkce
n17:WRD
n3:wos
000258094800030
n3:zahajeniAkce
2008-06-24+02:00
n3:zamer
n11:AV0Z40500505
s:numberOfPages
4
n8:hasPublisher
Academia Romana
n15:isbn
978-960-6766-75-6