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  • Recent experimental studies on the Watson?Crick type base pairing of triazine and aminopyrimidine derivatives suggest that acid/base properties of the constituent bases might be related to the duplex stabilities measured in solution. Herein we use high-level quantum chemical calculations and molecular dynamics simulations to evaluate the base pairing and stacking interactions of seven selected base pairs, which are common in that they are stabilized by two N_H???O hydrogen bonds separated by one N_H???N hydrogen bond.
  • Recent experimental studies on the Watson?Crick type base pairing of triazine and aminopyrimidine derivatives suggest that acid/base properties of the constituent bases might be related to the duplex stabilities measured in solution. Herein we use high-level quantum chemical calculations and molecular dynamics simulations to evaluate the base pairing and stacking interactions of seven selected base pairs, which are common in that they are stabilized by two N_H???O hydrogen bonds separated by one N_H???N hydrogen bond. (en)
Title
  • Theoretical Studies on the Intermolecular Interactions of Potentially Primordial Base-Pair Analogues
  • Theoretical Studies on the Intermolecular Interactions of Potentially Primordial Base-Pair Analogues (en)
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  • Theoretical Studies on the Intermolecular Interactions of Potentially Primordial Base-Pair Analogues
  • Theoretical Studies on the Intermolecular Interactions of Potentially Primordial Base-Pair Analogues (en)
skos:notation
  • RIV/61989592:15310/10:10215403!RIV11-GA0-15310___
http://linked.open...avai/riv/aktivita
http://linked.open...avai/riv/aktivity
  • P(1QS500040581), P(GA203/09/1476), P(GD203/09/H046), P(IAA400040802), P(LC06030), P(LC512), Z(AV0Z50040507), Z(AV0Z50040702), Z(MSM0021622413), Z(MSM6198959216)
http://linked.open...iv/cisloPeriodika
  • 10
http://linked.open...vai/riv/dodaniDat
http://linked.open...aciTvurceVysledku
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http://linked.open...dnocenehoVysledku
  • 292658
http://linked.open...ai/riv/idVysledku
  • RIV/61989592:15310/10:10215403
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  • quantum chemistry, base pairing, origin of life, molecular dynamics (en)
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http://linked.open...odStatuVydavatele
  • DE - Spolková republika Německo
http://linked.open...ontrolniKodProRIV
  • [05B5BB688AEB]
http://linked.open...i/riv/nazevZdroje
  • Chemistry: A European Journal
http://linked.open...in/vavai/riv/obor
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http://linked.open...v/svazekPeriodika
  • 16
http://linked.open...iv/tvurceVysledku
  • BANÁŠ, Pavel
  • OTYEPKA, Michal
  • ŠPONER, Judit E.
  • FUENTES-CABRERA, Miguel
  • LESZCZYNSKI, Jerzy
  • SUMPTER, Bobby G.
  • VAZQUEZ-MAYAGOITA, Alvaro
  • ŠPONER, Jiří
http://linked.open...ain/vavai/riv/wos
  • 000275943400013
http://linked.open...n/vavai/riv/zamer
issn
  • 0947-6539
number of pages
http://localhost/t...ganizacniJednotka
  • 15310
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