Anomerization reaction of bare and microhydrated d-erythrose via explicitly correlated coupled cluster approach. Two water molecules are optimal

scientific article published on 29 November 2016

Anomerization reaction of bare and microhydrated d-erythrose via explicitly correlated coupled cluster approach. Two water molecules are optimal is …
instance of (P31):
scholarly articleQ13442814

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P8978DBLP publication IDjournals/jcc/SzczepaniakM17
P356DOI10.1002/JCC.24680
P698PubMed publication ID27896831

P50authorJerzy MocQ90028143
P2093author name stringMarek Szczepaniak
P2860cites workTheoretical study of the mutarotation of erythrose and threose: acid catalysis.Q51824496
Kinetics of oxygen exchange at the anomeric carbon atom of D-glucose and D-erythrose using the oxygen-18 isotope effect in carbon-13 nuclear magnetic resonance spectroscopyQ52712656
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Kinetic processes in supercooled monosaccharides upon melting: Application of dielectric spectroscopy in the mutarotation studies of D-riboseQ43054926
Conformational choice and selectivity in singly and multiply hydrated monosaccharides in the gas phaseQ44638004
Conformational studies of gas-phase ribose and 2-deoxyribose by density functional, second order PT and multi-level method calculations: the pyranoses, furanoses, and open-chain structuresQ45813491
Mutarotation in D-fructose melt monitored by dielectric spectroscopyQ46103553
Tautomers of Gas-Phase Erythrose and Their Interconversion Reactions: Insights from High-Level ab Initio StudyQ46657098
Cyclic and acyclic fructose conformers in the gas phase: a large-scale second-order perturbation theory studyQ46854013
The kinetics of mutarotation in L-fucose as monitored by dielectric and infrared spectroscopy.Q46882686
P433issue5
P407language of work or nameEnglishQ1860
P304page(s)288-303
P577publication date2016-11-29
P1433published inJournal of Computational ChemistryQ3186908
P1476titleAnomerization reaction of bare and microhydrated d-erythrose via explicitly correlated coupled cluster approach. Two water molecules are optimal
P478volume38

Reverse relations

Q46329461Computational study of Simultaneous synthesis of optically active (RS)-1,2,4-butanetriol trinitrate (BTTN).cites workP2860

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