Publications by the researcher in collaboration with Gianni Podda (27)

2015

  1. Métodos grafo-numéricos de relevancia para la bioinformática. Aplicaciones en la biotecnología vegetal y en el descubrimiento de fármacos

    Anales de la Academia de Ciencias de Cuba, Vol. 5, Núm. 3

2011

  1. Synthesis, human monoamine oxidase inhibitory activity and molecular docking studies of 3-heteroarylcoumarin derivatives

    European Journal of Medicinal Chemistry, Vol. 46, Núm. 4, pp. 1147-1152

2010

  1. A new computational chemistry and complex networks approach to structure-function and similarity relationships in protein enzymes

    Handbook of Computational Chemistry Research (Nova Science Publishers, Inc.), pp. 387-408

  2. Regioselective synthesis of bromo-substituted 3-arylcoumarins

    Synthesis, pp. 2763-2766

  3. Review of MARCH-INSIDE & complex networks prediction of drugs: ADMET, anti-parasite activity, metabolizing enzymes and cardiotoxicity proteome biomarkers

    Current Drug Metabolism, Vol. 11, Núm. 4, pp. 379-406

  4. Review of QSAR models for Enzyme classes of drug targets: Theoretical background and applications in parasites, hosts and other organisms

    Current Pharmaceutical Design, Vol. 16, Núm. 24, pp. 2710-2723

  5. Synthesis and vasorelaxant and platelet antiaggregatory activities of a new series of 6-Halo-3-phenylcoumarins

    Molecules, Vol. 15, Núm. 1, pp. 270-279

2009

  1. 3D entropy and moments prediction of enzyme classes and experimental-theoretic study of peptide fingerprints in Leishmania parasites

    Biochimica et Biophysica Acta - Proteins and Proteomics, Vol. 1794, Núm. 12, pp. 1784-1794

  2. Computational chemistry study of 3D-structure-function relationships for enzymes based on markov models for protein electrostatic, HINT, and van der waals potentials

    Journal of Computational Chemistry, Vol. 30, Núm. 9, pp. 1510-1520

  3. Prediction of enzyme classes from 3D structure: A general model and examples of experimental-theoretic scoring of peptide mass fingerprints of Leishmania proteins

    Journal of Proteome Research, Vol. 8, Núm. 9, pp. 4372-4382

  4. Synthesis of regioisomeric functionalized benzodifurans and angelicins

    Helvetica Chimica Acta, Vol. 92, Núm. 7, pp. 1309-1314

  5. Tyrosinase inhibitor activity of coumarin-resveratrol hybrids

    Molecules, Vol. 14, Núm. 7, pp. 2514-2520

2008

  1. Synthesis and complete assignment of the 1H and 13C NMR signals of some oxopyrancoumarin and oxofuropyrancoumarin derivatives

    Magnetic Resonance in Chemistry, Vol. 46, Núm. 7, pp. 701-705

  2. Using spectral moments of spiral networks based on PSA/mass spectra outcomes to derive quantitative proteome-disease relationships (QPDRs) and predicting prostate cancer

    Biochemical and Biophysical Research Communications, Vol. 372, Núm. 2, pp. 320-325

2007

  1. 2D-RNA-coupling numbers: A new computational chemistry approach to link secondary structure topology with biological function

    Journal of Computational Chemistry, Vol. 28, Núm. 6, pp. 1049-1056

  2. Computational chemistry comparison of stable/nonstable protein mutants classification models based on 3d and topological indices

    Journal of Computational Chemistry, Vol. 28, Núm. 12, pp. 1990-1995

  3. Computational chemistry development of a unified free energy Markov Model for the distribution of 1300 chemicals to 38 different environmental or biological systems

    Journal of Computational Chemistry, Vol. 28, Núm. 11, pp. 1909-1923

  4. On the applicability of QSAR for recognition of miRNA bioorganic structures at early stages of organism and cell development: Embryo and stem cells

    Bioorganic and Medicinal Chemistry, Vol. 15, Núm. 7, pp. 2544-2550

2004

  1. Characterisation of new pyridazinofurocoumarins by electron ionisation and multiple stage tandem mass spectrometry using an ion trap mass spectrometer

    Rapid Communications in Mass Spectrometry

2003

  1. Characterization of some isomeric furocoumarinones using gas chromatography ion trap tandem mass spectrometry

    Spectroscopy Letters