Publicacións en colaboración con investigadores/as de Universidad de Concepción (6)

2021

  1. Corrigendum to “Mechanistic study of the biosynthesis of R-phenylacetylcarbinol by acetohydroxyacid synthase enzyme using hybrid quantum mechanics/molecular mechanics simulations” [Arch. Biochem. Biophys. 701 (2021) 108807] (Arch. Biochem. Biophys.(2021) 701 (108807) (S0003-9861(21)00057-6) (10.1016/j.abb.2021.108807))

    Archives of Biochemistry and Biophysics

  2. Erratum: Mechanistic study of the biosynthesis of R-phenylacetylcarbinol by acetohydroxyacid synthase enzyme using hybrid quantum mechanics/molecular mechanics simulations (Archives of Biochemistry and Biophysics (2021) 701, (S0003986121000576), (10.1016/j.abb.2021.108807))

    Archives of Biochemistry and Biophysics

  3. Mechanistic study of the biosynthesis of R-phenylcarbinol by acetohydroxyacid synthase enzyme using hybrid quantum mechanics/molecular mechanics simulations

    Archives of Biochemistry and Biophysics, Vol. 701

2019

  1. A molecular dynamics study on the role of the protonation state in the biosynthesis of R-PAC by AHAS

    Chemical Physics Letters, Vol. 716, pp. 247-251

2018

  1. Catalytic Reaction Mechanism in Native and Mutant Catechol- O-methyltransferase from the Adaptive String Method and Mean Reaction Force Analysis

    Journal of Physical Chemistry B, Vol. 122, Núm. 38, pp. 8861-8871

2017

  1. A DFT study on the chiral synthesis of R-phenylacetyl carbinol within the quantum chemical cluster approach

    Chemical Physics Letters, Vol. 677, pp. 30-34