Publicaciones en las que colabora con NATALIA DIAZ FERNANDEZ (5)

2014

  1. A combined semiempirical and DFT computational protocol for studying bioorganometallic complexes: Application to molybdocene-cysteine complexes

    Journal of Computational Chemistry, Vol. 35, Núm. 4, pp. 324-334

2011

  1. Quantum chemical calculations of stability constants: Study of ligand effects on the relative stability of Pd(II)-peptide complexes

    Theoretical Chemistry Accounts, Vol. 128, Núm. 4, pp. 465-475

2010

  1. 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. 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

2006

  1. Theoretical studies on the ring opening of β-lactams: Processes in solution and in enzymatic media

    Current Organic Chemistry, Vol. 10, Núm. 7, pp. 805-821