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61.
62.
Giovanni Carlo Alfonso Antonio Turturro Maria Pizzoli Mariastella Scandola Giuseppina Ceccorulli 《Journal of Polymer Science.Polymer Physics》1989,27(6):1195-1208
Thermal measurements were carried out to investigate the macrostructure of as-cast poly(vinylidene fluoride) (PVDF)/poly(vinyl pyrrolidone) (PVP) blends. At high PVP content, above about 70 wt.%, the two components form a homogeneously mixed amorphous phase whose Tg varies with composition. Crystals are formed upon casting mixtures richer in PVDF; these systems exhibit complex thermal behavior that cannot be justified by a simple two-phase model. DSC measurements above room temperature on semicrystalline blends show, in addition to the melting of PVDF crystals at temperatures that decrease on increasing PVP content, a glass transition at about 80°C, independent of composition. Experimental results strongly support the hypothesis that an interphase, composed of essentially undiluted noncrystalline PVDF, is always associated with the lamellar crystals. 相似文献
63.
A manganese(II) complex with N,N′-bis(carboxymethyl)dithiooxamide (H4GLYDTO), [Mn(H2GLYDTO)(H2O)2]n, has been synthesized and characterized by elemental analysis and thermogravimetric analysis, as well as by infrared, electronic and EPR spectroscopy and magnetic susceptibility measurements. The crystal and molecular structure of this complex was determined by single-crystal X-ray structure analysis. The compound shows a 3D porous framework with alternate left- and right-handed helical channels where the manganese(II) ions have an octahedral environment. Variable temperature magnetic measurements reveal the existence of very weak antiferromagnetic interactions through the syn-anti carboxylate bridge, with an exchange parameter of J/k = −0.12 K. 相似文献
64.
Isolda C. Mendes Fernanda B. Costa Geraldo M. de Lima José D. Ardisson Isabel Garcia-Santos Alfonso Castiñeiras Heloisa Beraldo 《Polyhedron》2009,28(6):1179-1185
Reaction of tin tetrachloride with 2-pyridineformamide thiosemicarbazone (H2Am4DH) and its N(4)-methyl (H2Am4Me), N(4)-ethyl (H2Am4Et) and N(4)-phenyl (H2Am4Ph) derivatives gave [Sn(2Am4DH)Cl3] (1), [Sn(2Am4Me)Cl3] (2), [Sn(2Am4Et)Cl3] (3) and [Sn(2Am4Ph)Cl3] (4) as products, in which an anionic thiosemicarbazone coordinates to the metal centre along with three chloride ions. The crystal structures of 1 and 2 were determined. The thiosemicarbazones were moderately active against Candida albicans and Pseudomonas aeruginosa. Upon coordination to tin(IV) the antimicrobial activity of the thiosemicarbazones increases. The studied compounds proved to be toxic to Artemia salina, suggesting that they could present cytotoxic activity against solid tumors. 相似文献
65.
Alfonso Romero 《manuscripta mathematica》1987,59(3):261-276
The rigidity for full holomorphic isometric immersions of an indefinite Kähler manifold into an indefinite complex space form is proved. All such immersions between indefinite complex projective (and hyperbolic) spaces are founded and examples of non-congruents holomorphic isometric immersions are exposed. 相似文献
66.
Arezou Rezazadeh Josep Font-Segura Alfonso Martinez Albert Guilln i Fbregas 《Entropy (Basel, Switzerland)》2021,23(5)
This paper studies a generalized version of multi-class cost-constrained random-coding ensemble with multiple auxiliary costs for the transmission of N correlated sources over an N-user multiple-access channel. For each user, the set of messages is partitioned into classes and codebooks are generated according to a distribution depending on the class index of the source message and under the constraint that the codewords satisfy a set of cost functions. Proper choices of the cost functions recover different coding schemes including message-dependent and message-independent versions of independent and identically distributed, independent conditionally distributed, constant-composition and conditional constant composition ensembles. The transmissibility region of the scheme is related to the Cover-El Gamal-Salehi region. A related family of correlated-source Gallager source exponent functions is also studied. The achievable exponents are compared for correlated and independent sources, both numerically and analytically. 相似文献
67.
Computerized Developments in Design,Generation, Simulation of Meshing,and Stress Analysis of Gear Drives 总被引:4,自引:0,他引:4
Faydor?L.?Litvin Daniele?Vecchiato Eugene?Gurovich Alfonso?FuentesEmail author Ignacio?Gonzalez-Perez Kenichi?Hayasaka Kenji?Yukishima 《Meccanica》2005,40(3):291-323
The paper represents new computerized developments in design, generation, simulation of meshing, and stress analysis of gear drives. The main contents of the paper are: (i) application of a predesigned parabolic function of transmission errors for reduction of noise, (ii) computerized simulation of noise caused by transmission errors, (iii) modification of the basic algorithm of tooth contact analysis, and (iv) application of approaches developed for enhanced design and simulation of meshing of the following gear drives: (a) spiral bevel gear drives, (b) face-gear drives (including an approach for grinding), and (c) modified helical gear drives. The developed theory is illustrated with numerical examples. 相似文献
68.
Ignacio Alfonso Dr. Miriam Bru Dr. M. Isabel Burguete Dr. Eduardo García‐Verdugo Dr. Santiago V. Luis Prof. Dr. 《Chemistry (Weinheim an der Bergstrasse, Germany)》2010,16(4):1246-1255
The self‐assembling abilities of several pseudopeptidic macrocycles have been thoroughly studied both in the solid (SEM, TEM, FTIR) and in solution (NMR, UV, CD, FTIR) states. Detailed microscopy revealed large differences in the morphology of the self‐assembling micro/nanostructures depending on the macrocyclic chemical structures. Self‐assembly was triggered by the presence of additional methylene groups or by changing from para to meta geometry of the aromatic phenylene backbone moiety. More interestingly, the nature of the side chain also plays a fundamental role in some of the obtained nanostructures, thus producing structures from long fibers to hollow spheres. These nanostructures were obtained in different solvents and on different surfaces, thus implying that the chemical information for the self‐assembly is contained in the molecular structure. Dilution NMR studies (chemical shift and self‐diffusion rates) suggest the formation of incipient aggregates in solution by a combination of hydrogen‐bonding and π–π interactions, thus implicating amide and aryl groups, respectively. Electronic spectroscopy further supports the π–π interactions because the compounds that lead to fibers show large hypochromic shifts in the UV spectra. Moreover, the fiber‐forming macrocycles also showed a more intense CD signature. The hydrogen‐bonding interactions within the nanostructures were also characterized by attenuated total‐reflectance FTIR spectroscopy, which allowed us to monitor the complete transition from the solution to the dried nanostructure. Overall, we concluded that the self‐assembly of this family of pseudopeptidic macrocycles is dictated by a synergic action of hydrogen‐bonding and π–π interactions. The feasibility and geometrical disposition of these interactions finally render a hierarchical organization, which has been rationalized with a proposal of a model. The understanding of the process at the molecular level has allowed us to prepare hybrid soft materials. 相似文献
69.
Mario Alfonso Murillo-Tovar Omar Amador-Muñoz Rafael Villalobos-Pietrini Philip J. Marriott 《Chromatographia》2010,72(9-10):913-921
A fast and simple fractionation method was optimized to selectively separate oxy-PAH from polycyclic aromatic hydrocarbons (PAH) and n-alkanes contained in solvent extracted organic matter (SEOM) from atmospheric particles with an aerodynamic diameter ≤2.5 μm (PM2.5). Samples were collected in Mexico City. Multivariate parameters were adjusted on a standard mixture, and on SEOM spiked with pure standard mixture solutions: type and amount of phase; packing densities; type, proportion and amount of solvents, and elution flow rates were tested under several elution schemes. Cyanopropylsilyl-bonded phase material was the selected stationary phase. The separation method was applied to real samples of SEOM (2.6, 5.6 and 8.5 mg) spiked with n-alkanes, PAH and oxy-PAH. n-Alkanes overlapped with PAH due to an excess of n-alkanes in real samples overloading the capacity of the stationary phase. Oxy-PAH was separated totally from n-alkanes and PAH. Mean recoveries ± confidence intervals (95%) for n-alkanes ranged from 53 ± 17% (n-tetracontane) to 101 ± 11% (n-hexacosane); for PAH from 58 ± 5% (phenanthrene) to 85 ± 9% (benzo[k]fluoranthene); and for oxy-PAH from 68 ± 12% (9,10-dihydrobenzo[a]pyren-7(8H)one) to 108 ± 9% (1,2-benzopyrone). This method is an efficient fractionation procedure to be applied to oxy-PAH, PAH and n-alkanes in complex organic mixtures extracted from PM2.5. 相似文献
70.
Alfonso T. García‐Sosa Csaba Hetényi Uko Maran 《Journal of computational chemistry》2010,31(1):174-184
A dataset of protein‐drug complexes with experimental binding energy and crystal structure were analyzed and the performance of different docking engines and scoring functions (as well as components of these) for predicting the free energy of binding and several ligand efficiency indices were compared. The aim was not to evaluate the best docking method, but to determine the effect of different efficiency indices on the experimental and predicted free energy. Some ligand efficiency indices, such as ΔG/W (Wiener index), ΔG/NoC (number of carbons), and ΔG/P (partition coefficient), improve the correlation between experimental and calculated values. This effect was shown to be valid across the different scoring functions and docking programs. It also removes the common bias of scoring functions in favor of larger ligands. For all scoring functions, the efficiency indices effectively normalize the free energy derived indices, to give values closer to experiment. Compound collection filtering can be done prior or after docking, using pharmacokinetic as well as pharmacodynamic profiles. Achieving these better correlations with experiment can improve the ability of docking scoring functions to predict active molecules in virtual screening. © 2009 Wiley Periodicals, Inc. J Comput Chem 2010 相似文献