Publications in collaboration with researchers from Universidad de Oviedo (14)

2022

  1. Evaluation of biostimulation, bioaugmentation, and organic amendments application on the bioremediation of recalcitrant hydrocarbons of soil

    Chemosphere, Vol. 307

2019

  1. 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

  2. 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

  1. 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

  2. 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

  1. Peptide binding to β-cyclodextrins: Structure, dynamics, energetics, and electronic effects

    Journal of Physical Chemistry A, Vol. 115, Núm. 42, pp. 11810-11817

2010

  1. 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

  2. Computer simulation of reactions in β-cyclodextrin molecular reactors: Transition state recognition

    Organic and Biomolecular Chemistry, Vol. 8, Núm. 19, pp. 4346-4355

  3. Reactivity of a rhenium hydroxo-carbonyl complex toward carbon disulfide: Insights from theory

    Dalton Transactions, Vol. 39, Núm. 3, pp. 874-882

  4. 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

  1. A theoretical study on the reactivity of a rhenium hydroxo-carbonyl complex towards β-lactams

    European Journal of Inorganic Chemistry, pp. 4547-4554

  2. 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

  1. 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

  2. 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