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Results:
1-14
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Results: 14
Authors:
GAO JL
AMARA P
ALHAMBRA C
FIELD MJ
Citation: Jl. Gao et al., A GENERALIZED HYBRID ORBITAL (GHO) METHOD FOR THE TREATMENT OF BOUNDARY ATOMS IN COMBINED QM MM CALCULATIONS/, The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 102(24), 1998, pp. 4714-4721
Authors:
MARCOCONTELLES J
ALHAMBRA C
MARTINEZGRAU A
Citation: J. Marcocontelles et al., CARBOCYCLES FROM CARBOHYDRATES VIA FREE-RADICAL CYCLIZATIONS - SYNTHESIS AND MANIPULATION OF ANNULATED FURANOSES, Synlett, (7), 1998, pp. 693-699
Authors:
ALHAMBRA C
WU L
ZHANG ZY
GAO JL
Citation: C. Alhambra et al., WALDEN-INVERSION-ENFORCED TRANSITION-STATE STABILIZATION IN A PROTEIN-TYROSINE-PHOSPHATASE, Journal of the American Chemical Society, 120(16), 1998, pp. 3858-3866
Authors:
ALHAMBRA C
LUQUE FJ
GAGO F
OROZCO M
Citation: C. Alhambra et al., AB-INITIO STUDY OF STACKING INTERACTIONS IN A-DNA AND B-DNA, JOURNAL OF PHYSICAL CHEMISTRY B, 101(19), 1997, pp. 3846-3853
Authors:
GAO JL
ALHAMBRA C
Citation: Jl. Gao et C. Alhambra, A HYBRID SEMIEMPIRICAL QUANTUM-MECHANICAL AND LATTICE-SUM METHOD FOR ELECTROSTATIC INTERACTIONS IN FLUID SIMULATIONS, The Journal of chemical physics, 107(4), 1997, pp. 1212-1217
Authors:
GAO JL
ALHAMBRA C
Citation: Jl. Gao et C. Alhambra, SOLVENT EFFECTS ON THE BOND-LENGTH ALTERNATION AND ABSORPTION ENERGY OF CONJUGATED COMPOUNDS, Journal of the American Chemical Society, 119(12), 1997, pp. 2962-2963
Authors:
OROZCO M
ALHAMBRA C
BARRIL X
LOPEZ JM
BUSQUETS MA
LUQUE FJ
Citation: M. Orozco et al., THEORETICAL METHODS FOR THE REPRESENTATION OF SOLVENT, JOURNAL OF MOLECULAR MODELING, 2(1), 1996, pp. 1-15
Authors:
OROZCO M
LOPEZ JM
COLOMINES C
ALHAMBRA C
BUSQUETS MA
LUQUE FJ
Citation: M. Orozco et al., THEORETICAL REPRESENTATION OF SOLVATION IN BIOCHEMICAL SYSTEMS - FROMDISCRETE SOLUTE-SOLVENT INTERACTIONS TO BULK SOLVATION, International journal of quantum chemistry, 60(6), 1996, pp. 1179-1187
Authors:
LUQUE FJ
ALHAMBRA C
OROZCO M
Citation: Fj. Luque et al., EFFECT OF SOLVENT POLARIZATION ON BIMOLECULAR INTERACTIONS, Journal of physical chemistry, 99(29), 1995, pp. 11344-11349
Authors:
ALHAMBRA C
LUQUE FJ
OROZCO M
Citation: C. Alhambra et al., MOLECULAR SOLVATION POTENTIAL - A NEW TOOL FOR THE QUANTUM-MECHANICALDESCRIPTION OF HYDRATION IN ORGANIC AND BIOORGANIC MOLECULES, Journal of physical chemistry, 99(10), 1995, pp. 3084-3092
Authors:
ALHAMBRA C
LUQUE FJ
ESTELRICH J
OROZCO M
Citation: C. Alhambra et al., TAUTOMERISM OF NEUTRAL AND PROTONATED 6-THIOGUANINE IN THE GAS-PHASE AND IN AQUEOUS-SOLUTION - AN AB-INITIO STUDY, Journal of organic chemistry, 60(4), 1995, pp. 969-976
Authors:
ALHAMBRA C
LUQUE FJ
PORTUGAL J
OROZCO M
Citation: C. Alhambra et al., MOLECULAR-DYNAMICS STUDY OF THE BINDING OF ELSAMICIN-A TO DNA, European journal of biochemistry, 230(2), 1995, pp. 555-566
Authors:
ALHAMBRA C
LUQUE FJ
OROZCO M
Citation: C. Alhambra et al., COMPARISON OF NDDO AND QUASI-AB INITIO APPROACHES TO COMPUTE SEMIEMPIRICAL MOLECULAR ELECTROSTATIC POTENTIALS, Journal of computational chemistry, 15(1), 1994, pp. 12-22
Authors:
VEGA MC
ALEMAN C
ALHAMBRA C
PEREZ JJ
Citation: Mc. Vega et al., EFFECTS OF DIFFERENT CONTINUUM DIELECTRIC MODELS IN A MOLECULAR-DYNAMICS AND ENERGY MINIMIZATION STUDY OF THE ANTIGENIC LOOP OF FOOT-AND-MOUTH-DISEASE VIRUS, Journal of biomolecular structure & dynamics, 11(2), 1993, pp. 429-441
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