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rdf:type
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Description
| - Base stacking energies in ten unique B-DNA base-pair steps and some other arrangements were evaluated by the second-order Moller-Plesset (MP2) method; complete basis set (CBS) extrapolation and correction for triple (T) electron-correlation contributions. The CBS(T) calculations were compared with decade old MP2/6-31G* (0.25) reference data and AMBER force field.
- Base stacking energies in ten unique B-DNA base-pair steps and some other arrangements were evaluated by the second-order Moller-Plesset (MP2) method; complete basis set (CBS) extrapolation and correction for triple (T) electron-correlation contributions. The CBS(T) calculations were compared with decade old MP2/6-31G* (0.25) reference data and AMBER force field. (en)
- Base stacking energie v deseti jedinečných B-DNA base-pair krocích a dalších uspořádání byli vyhodnocené Miller-Plesset metodou druhého řádu (MP2); extrapolace úplné sady bázi (CBS) a korelace pro tří (T) elektron-korelační příspěvky. CBS výpočty byly porovnané s deset roků starými MP2/6-31G* (0.25) referenčními daty a silovým polem AMBER. (cs)
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Title
| - Nature of base stacking: Reference quantum-chemical stacking energies in ten unique B-DNA base-pair steps
- Nature of base stacking: Reference quantum-chemical stacking energies in ten unique B-DNA base-pair steps (en)
- Povaha base-stackingu: Referenční kvantově-chemická stacking energie v deseti jedinečných B-DNA base-pair stepech (cs)
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skos:prefLabel
| - Nature of base stacking: Reference quantum-chemical stacking energies in ten unique B-DNA base-pair steps
- Nature of base stacking: Reference quantum-chemical stacking energies in ten unique B-DNA base-pair steps (en)
- Povaha base-stackingu: Referenční kvantově-chemická stacking energie v deseti jedinečných B-DNA base-pair stepech (cs)
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skos:notation
| - RIV/68081707:_____/06:00039038!RIV07-AV0-68081707
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http://linked.open.../vavai/riv/strany
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http://linked.open...avai/riv/aktivita
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http://linked.open...avai/riv/aktivity
| - P(GA203/05/0009), P(GA203/05/0388), P(LC512), Z(AV0Z40550506), Z(AV0Z50040507)
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http://linked.open...iv/cisloPeriodika
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http://linked.open...vai/riv/dodaniDat
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http://linked.open...aciTvurceVysledku
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http://linked.open.../riv/druhVysledku
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http://linked.open...iv/duvernostUdaju
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http://linked.open...titaPredkladatele
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http://linked.open...dnocenehoVysledku
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http://linked.open...ai/riv/idVysledku
| - RIV/68081707:_____/06:00039038
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http://linked.open...riv/jazykVysledku
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http://linked.open.../riv/klicovaSlova
| - ab initio calculations; DNA structures; nucleobases (en)
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http://linked.open.../riv/klicoveSlovo
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http://linked.open...odStatuVydavatele
| - DE - Spolková republika Německo
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http://linked.open...ontrolniKodProRIV
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http://linked.open...i/riv/nazevZdroje
| - Chemistry - A European Journal
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http://linked.open...in/vavai/riv/obor
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http://linked.open...ichTvurcuVysledku
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http://linked.open...cetTvurcuVysledku
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http://linked.open...vavai/riv/projekt
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http://linked.open...UplatneniVysledku
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http://linked.open...v/svazekPeriodika
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http://linked.open...iv/tvurceVysledku
| - Hobza, Pavel
- Šponer, Jiří
- Jurečka, Petr
- Orozco, M.
- Luque, F. J.
- Marchan, I.
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http://linked.open...n/vavai/riv/zamer
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issn
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number of pages
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