Publicacións nas que colabora con Miguel Ángel Ríos Fernández (16)

1994

  1. Parametrization of a force field for studying some beta‐lactams

    Journal of Computational Chemistry, Vol. 15, Núm. 4, pp. 455-465

1993

  1. A Semi‐empirical Study of some Clavulanic Acid Derivatives in Relation to their Activity as β‐Lactamase Inhibitors

    Journal of Pharmacy and Pharmacology, Vol. 45, Núm. 1, pp. 25-29

1992

  1. A theoretical study of 1-amino-3-butene and 3-butene-1-thiol

    Structural Chemistry, Vol. 3, Núm. 4, pp. 225-229

  2. Conformation and charge distribution of bicyclic β‐lactams: Structure–activity relationships

    Biopolymers, Vol. 32, Núm. 1, pp. 97-106

  3. Theoretical study of some nitriles: Intramolecular hydrogen bonds and anomeric effect

    Journal of Computational Chemistry, Vol. 13, Núm. 6, pp. 722-729

1991

  1. An ab initio conformational analysis of isobutylamine and diisopropylamine

    Journal of Molecular Structure: THEOCHEM, Vol. 251, Núm. C, pp. 319-326

  2. An ab initio study of proton transfer in triose reductone

    Journal of Molecular Structure: THEOCHEM, Vol. 226, Núm. 3-4, pp. 181-196

  3. Conformational analysis of bicyclic systems including the NCO unit by molecular mechanics Part II. 4,5- and 5,6- Tetramethylene perhydro-1,3-oxazines

    Journal of Molecular Structure, Vol. 246, Núm. 3-4, pp. 301-319

  4. Conformational analysis of bicyclic systems including the NCO unit by molecular mechanics. Part I. Perhydropyrido [1,2-c][1,3] oxazines

    Journal of Molecular Structure, Vol. 245, Núm. 1-2, pp. 53-67

  5. Molecular mechanics (MM2) and conformational analysis of compounds with NCO units. Parametrization of the force field and anomeric effect

    Journal of Computational Chemistry, Vol. 12, Núm. 1, pp. 78-90

1990

  1. AB initio studies of molecules with N-C-O units. Part 2. 1-oxa-3-azacyclohexane, 1-oxa-3,5-diazacyclohexane and 1,3-dioxa-5-azacyclohexane

    Journal of Molecular Structure: THEOCHEM, Vol. 206, Núm. 1-2, pp. 29-38

  2. Ab Initio studies of molecules with N-C-O units. Part IV. N,N-dimethylaminomethanol, 2-amino-2-propanol and 1-methylaminoethanol

    Journal of Molecular Structure: THEOCHEM, Vol. 209, Núm. 3-4, pp. 201-209

  3. Ab initio gradient conformational analysis of polyazocyclohexanes:1,4-diazocyclohexane, 1,3-diazocyclohexane and 1,3,5-triazocyclohexane

    Journal of Molecular Structure: THEOCHEM, Vol. 205, Núm. C, pp. 223-234

  4. Ab initio studies of molecules with N-C-O units. Part I. Methylaminomethanol, 1-methoxymethylamine and 1-methoxy-N-N-dimethyl-methylamine

    Journal of Molecular Structure: THEOCHEM, Vol. 205, Núm. C, pp. 235-244

  5. Ab initio studies of molecules with N-C-O units. Part III. 1-Methoxy-N-methyl-methylamine and 1-aminoethanol

    Journal of Molecular Structure: THEOCHEM, Vol. 206, Núm. 3-4, pp. 277-285

1989

  1. Study of the geometric trends and rotational constants of 1-fluoro-2-propanol and 2-fluoropropanol by Ab Initio calculations

    Tetrahedron Computer Methodology, Vol. 2, Núm. 2, pp. 85-92