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Results: 1-25/52
Authors:
Munoz, J
Sponer, J
Hobza, P
Orozco, M
Luque, FJ
Citation: J. Munoz et al., Interactions of hydrated Mg2+ cation with bases, base pairs, and nucleotides. Electron topology, natural bond orbital, electrostatic, and vibrationalstudy, J PHYS CH B, 105(25), 2001, pp. 6051-6060
Authors:
Lavilla, R
Coll, O
Bosch, J
Orozco, M
Luque, FJ
Citation: R. Lavilla et al., General access to tacamine and vinca-eburna alkaloids through tandem non-biomimetic oxidation of dihydropyridines/Zn-mediated radical addition processes - Unexpected facial selectivity of flattened cyclohexyl-type radicals, EUR J ORG C, (19), 2001, pp. 3719-3729
Authors:
Barril, X
Gelpi, JL
Lopez, JM
Orozco, M
Luque, FJ
Citation: X. Barril et al., How accurate can molecular dynamics/linear response and Poisson-Boltzmann/solvent accessible surface calculations be for predicting relative binding affinities? Acetylcholinesterase huprine inhibitors as a test case, THEOR CH AC, 106(1-2), 2001, pp. 2-9
Authors:
Rueda, M
Luque, FJ
Lopez, JM
Orozco, M
Citation: M. Rueda et al., Amino-imino tautomerism in derivatives of cytosine: Effect on hydrogen-bonding and stacking properties, J PHYS CH A, 105(26), 2001, pp. 6575-6580
Authors:
Avino, A
Morales, JC
Frieden, M
de la Torre, BG
Garcia, RG
Cubero, E
Luque, FJ
Orozco, M
Azorin, F
Eritja, R
Citation: A. Avino et al., Parallel-stranded hairpins containing 8-aminopurines. Novel efficient probes for triple-helix formation, BIOORG MED, 11(13), 2001, pp. 1761-1763
Authors:
Orozco, M
Citation: M. Orozco, Translation and dubbing: Words, voices and images, PERSP ST TR, 9(1), 2001, pp. 45-46
Authors:
Orozco, M
Citation: M. Orozco, Teaching translation, PERSP ST TR, 9(1), 2001, pp. 54-55
Authors:
Osegueda, RA
Carrasco, CJ
Orozco, M
Eftis, J
Reynolds, E
Sholar, TG
Citation: Ra. Osegueda et al., Contour dust shield performance, J AEROSP E, 14(4), 2001, pp. 147-157
Authors:
Guardia, E
Pinzon, R
Casulleras, J
Orozco, M
Luque, FJ
Citation: E. Guardia et al., Comparison of different three-site interaction potentials for liquid acetonitrile, MOL SIMULAT, 26(4), 2001, pp. 287-306
Authors:
Gelpi, JL
Kalko, SG
Barril, X
Cirera, J
de la Cruz, X
Luque, FJ
Orozco, M
Citation: Jl. Gelpi et al., Classical molecular interaction potentials: Improved setup procedure in molecular dynamics simulations of proteins, PROTEINS, 45(4), 2001, pp. 428-437
Authors:
Soliva, R
Monaco, V
Gomez-Pinto, I
Meeuwenoord, NJ
Van der Marel, GA
Van Boom, JH
Gonzalez, C
Orozco, M
Citation: R. Soliva et al., Solution structure of a DNA duplex with a chiral alkyl phosphonate moiety, NUCL ACID R, 29(14), 2001, pp. 2973-2985
Authors:
Cubero, E
Guimil-Garcia, R
Luque, FJ
Eritja, R
Orozco, M
Citation: E. Cubero et al., The effect of amino groups on the stability of DNA duplexes and triplexes based on purines derived from inosine, NUCL ACID R, 29(12), 2001, pp. 2522-2534
Authors:
Curutchet, C
Orozco, M
Luque, FJ
Citation: C. Curutchet et al., Solvation in octanol: Parametrization of the continuum MST model, J COMPUT CH, 22(11), 2001, pp. 1180-1193
Authors:
Orozco, M
Luque, FJ
Citation: M. Orozco et Fj. Luque, Theoretical methods for the description of the solvent effect in biomolecular systems. (vol 100, pg 4187, 2000), CHEM REV, 101(1), 2001, pp. 203-203
Authors:
Cubero, E
Luque, FJ
Orozco, M
Citation: E. Cubero et al., Theoretical studies of d(A : T)-based parallel-stranded DNA duplexes, J AM CHEM S, 123(48), 2001, pp. 12018-12025
Authors:
Kalko, SG
Gelpi, JL
Fita, I
Orozco, M
Citation: Sg. Kalko et al., Theoretical study of the mechanisms of substrate recognition by catalase, J AM CHEM S, 123(39), 2001, pp. 9665-9672
Authors:
Hobza, P
Sponer, J
Cubero, E
Orozco, M
Luque, FJ
Citation: P. Hobza et al., C-H center dot center dot center dot O contacts in the adenine center dot center dot center dot uracil Watson-Crick and uracil center dot center dot center dot uracil nucleic acid base pairs: Nonempirical ab initio study with inclusion of electron correlation effects, J PHYS CH B, 104(26), 2000, pp. 6286-6292
Authors:
Barril, X
Munoz, J
Luque, FJ
Orozco, M
Citation: X. Barril et al., Simplified descriptions of the topological distribution of hydrophilic/hydrophobic characteristics of molecules, PHYS CHEM P, 2(21), 2000, pp. 4897-4905
Authors:
Luque, FJ
Lopez, JM
Orozco, M
Citation: Fj. Luque et al., Perspective on "Electrostatic interactions of a solute with a continuum. Adirect utilization of ab initio molecular potentials for the prevision of solvent effects" - Miertus S, Scrocco E, Tomasi J (1981) Chem Phys 55 : 117, THEOR CH AC, 103(3-4), 2000, pp. 343-345
Authors:
Hernandez, B
Luque, FJ
Orozco, M
Citation: B. Hernandez et al., Mixed QM/MM molecular electrostatic potentials, J COMPUT A, 14(4), 2000, pp. 329-339
Authors:
Hernandez, B
Soliva, R
Luque, FJ
Orozco, M
Citation: B. Hernandez et al., Misincorporation of 2 '-deoxyoxanosine into DNA: a molecular basis for NO-induced mutagenesis derived from theoretical calculations, NUCL ACID R, 28(24), 2000, pp. 4873-4883
Authors:
Soliva, R
Garcia, RG
Blas, JR
Eritja, R
Asensio, JL
Gonzalez, C
Luque, FJ
Orozco, M
Citation: R. Soliva et al., DNA-triplex stabilizing properties of 8-aminoguanine, NUCL ACID R, 28(22), 2000, pp. 4531-4539
Authors:
Busquets, C
Merinero, B
Christensen, E
Gelpi, JL
Campistol, J
Pineda, M
Fernandez-Alvarez, E
Prats, JM
Sans, A
Arteaga, R
Marti, M
Campos, J
Martinez-Pardo, M
Martinez-Bermejo, A
Ruiz-Falco, ML
Vaquerizo, J
Orozco, M
Ugarte, M
Coll, MJ
Ribes, A
Citation: C. Busquets et al., Glutaryl-CoA dehydrogenase deficiency in Spain: Evidence of two groups of patients, genetically, and biochemically distinct, PEDIAT RES, 48(3), 2000, pp. 315-322
Authors:
Amat, M
Bosch, J
Hidalgo, J
Canto, M
Perez, M
Llor, N
Molins, E
Miravitlles, C
Orozco, M
Luque, J
Citation: M. Amat et al., Synthesis of enantiopure trans-3,4-disubstituted piperidines. An enantiodivergent synthesis of (+)- and (-)-paroxetine, J ORG CHEM, 65(10), 2000, pp. 3074-3084
Authors:
Camps, P
El Achab, R
Morral, J
Munoz-Torrero, D
Badia, A
Banos, JE
Vivas, NM
Barril, X
Orozco, M
Luque, FJ
Citation: P. Camps et al., New tacrine-huperzine A hybrids (huprines): Highly potent tight-binding acetylcholinesterase inhibitors of interest for the treatment of Alzheimer's disease, J MED CHEM, 43(24), 2000, pp. 4657-4666