PARQUE CIENTÍFICO TECNOLÓGICO
Facultad/Centro de investigación
Universidad de Oviedo
Oviedo, EspañaPublicaciones en colaboración con investigadores/as de Universidad de Oviedo (14)
2022
2019
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Applying new technologies to the taphonomic study of La Lluera (Asturias, Spain). Geometric morphometrics and the study of bone surface modifications (BSM)
Quaternary International, Vol. 517, pp. 107-117
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Skeletal Anomalies in The Neandertal Family of El Sidrón (Spain) Support A Role of Inbreeding in Neandertal Extinction
Scientific Reports, Vol. 9, Núm. 1
2013
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Atomistic molecular point of view for liquid lead and lithium in Nuclear Fusion technology
Journal of Nuclear Materials, Vol. 440, Núm. 1-3, pp. 98-103
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Taste for chiral guests: Investigating the stereoselective binding of peptides to β-cyclodextrins
Journal of Physical Chemistry B, Vol. 117, Núm. 11, pp. 3091-3097
2011
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Peptide binding to β-cyclodextrins: Structure, dynamics, energetics, and electronic effects
Journal of Physical Chemistry A, Vol. 115, Núm. 42, pp. 11810-11817
2010
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A computational study on the stability-aromaticity correlation of triply N-confused porphyrins: CMMSE-09
Journal of Mathematical Chemistry, Vol. 48, Núm. 1, pp. 137-144
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Computer simulation of reactions in β-cyclodextrin molecular reactors: Transition state recognition
Organic and Biomolecular Chemistry, Vol. 8, Núm. 19, pp. 4346-4355
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Reactivity of a rhenium hydroxo-carbonyl complex toward carbon disulfide: Insights from theory
Dalton Transactions, Vol. 39, Núm. 3, pp. 874-882
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Understanding regioselective cleavage in peptide hydrolysis by a palladium(II) aqua complex: A theoretical point of view
Journal of Physical Chemistry B, Vol. 114, Núm. 25, pp. 8525-8535
2008
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A theoretical study on the reactivity of a rhenium hydroxo-carbonyl complex towards β-lactams
European Journal of Inorganic Chemistry, pp. 4547-4554
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Ring opening at N1-C2 bond of azetidin-2-ones by a molybdenum hydroxo-carbonyl complex: Evidence from a computational study
Dalton Transactions, pp. 6427-6434
2007
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A theoretical study of the cleavage of the amide bond of formamide by attack of the hydroxyl ligand in [Mo(OH)(η3-C3H5)(CO)2(N2C2H4)] and [Re(OH)(CO)3(N2C2H4)] complexes
Journal of Molecular Structure: THEOCHEM, Vol. 811, Núm. 1-3, pp. 241-247
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The importance of a conformational equilibrium on the reactivity of molybdenum and rhenium hydroxo-carbonyl complexes toward phenyl acetate: A theoretical investigation
Organometallics, Vol. 26, Núm. 22, pp. 5271-5277