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71.
Bongiorno D Ceraulo L Giorgi G Indelicato S Ferrugia M Ruggirello A Liveri VT 《Journal of mass spectrometry : JMS》2011,46(2):195-201
Self-assembling of amphiphilic molecules under electrospray ionization (ESI) conditions is characterized by quite unexpected phenomenology. The noticeable differences with respect to the condensed phase are attributable to the absence of the surfactant-solvent interactions, the presence of net charge in the aggregates, and the strong deviation from equilibrium conditions. Aiming to investigate the effects of the net charge on abundance and stability of supramolecular surfactant aggregates, positively and negatively charged aggregates of sodium bis(2-ethylhexyl)sulfosuccinate (AOT) and sodium methane sulfonate (MetS), butane sulfonate (ButS) and octane sulfonate (OctS) have been studied by ESI mass spectrometry, energy resolved mass spectrometry and density functional theory calculations. The negatively charged aggregates are found to be less stable than their positive counterparts. The results are consistent with a self-assembling pattern dominated by electrostatic interactions involving the counterions and head groups of the investigated amphiphilic compounds while the alkyl chains point outwards, protecting the aggregates from unlimited growth processes. 相似文献
72.
Multi-component, regio-selective aldol addition of β-ketoesters to aldehydes: scope and applications
More V Di Mola A Croce G Tedesco C Petronzi C Peduto A De Caprariis P Filosa R Massa A 《Organic & biomolecular chemistry》2011,9(24):8483-8488
Simple and effective multi-component one-pot aldol addition/protection reactions of β-ketoesters to a series of aldehydes in the presence Me(3)SiCl and i-Pr(2)EtN have been described. The analysis of the scope of the reaction revealed a dramatic dependence of the reactivity on the substrates used. Thus the effect of a catalytic amount of DMF and different reaction conditions was widely investigated. Further transformations of the aldol adducts were particularly useful to give valuable diols and compounds with quaternary stereocenters, while X-ray structural analysis gave also important stereochemical information about this challenging reaction. 相似文献
73.
Chiono V Sartori S Rechichi A Tonda-Turo C Vozzi G Vozzi F D'Acunto M Salvadori C Dini F Barsotti G Carlucci F Burchielli S Nicolino S Audisio C Perroteau I Giusti P Ciardelli G 《Macromolecular bioscience》2011,11(2):245-256
A biocompatible and elastomeric PU was synthesized from low-molecular-weight PCL as macrodiol, CMD as chain extender and HDI as chain linker for applications in the field of peripheral nerve repair. PU cast films supported in vitro attachment and proliferation of NOBEC. The in vitro adhesion and proliferation of S5Y5 neuroblastoma cells on the inner surface of uncoated, gelatin- and PL-coated PU guides were compared. Due to their superior in vitro performance, PL-coated PU guides were tested in vivo for the repair of 1.8 cm-long defects in rat sciatic nerves. The progressive regeneration was confirmed by EMG and histological analysis showing the presence of regenerating fibers in the distal stumps. 相似文献
74.
Blangetti M Croce G Deagostino A Mussano E Prandi C Venturello P 《The Journal of organic chemistry》2011,76(6):1814-1820
The direct addition of metalated alkoxydiene 2, obtained from α,β-unsaturated acetal 1 through a LIC-KOR-promoted conjugated elimination reaction, to enantiopure sulfinimines 3 (both R and SN-sulfinyl imines) afforded N-sulfinyl alkoxydienyl amines 4 with high diastereoselectivity. Functionalized enantiopure alkoxydienyl amines 5 were then easily obtained upon the selective removal of the chiral auxiliary under mild conditions. Moreover, the further hydrolysis of the alkoxydienyl moiety gave access to protected enantiopure β-keto amines 7. 相似文献
75.
In order to use a predicted protein structure one needs to know how good it is, as the utility of a model depends on its quality. To this aim, many Model Quality Assessment Programs (MQAP) have been developed over the last decade, with MQAP also being assessed at the CASP competition. We present a new knowledge-based MQAP which evaluates single protein structure models. We use a tree representation of the Cα trace to train a novel Neural Network Pairwise Interaction Field (NN-PIF) to predict the global quality of a model. NN-PIF allows fast evaluation of multiple structure models for a single sequence. In our tests on a large set of structures, our networks outperform most other methods based on different and more complex protein structure representations in global model quality prediction. Moreover, given NN-PIF can evaluate protein conformations very fast, we train a separate version of the model to gauge its ability to fold protein structures ab initio. We show that the resulting system, which relies only on basic information about the sequence and the Cα trace of a conformation, generally improves the quality of the structures it is presented with and may yield promising predictions in the absence of structural templates, although more research is required to harness the full potential of the model. 相似文献
76.
77.
Journal of Nonlinear Science - We study the existence of quasistatic evolutions for a family of gradient damage models which take into account fatigue, that is the process of weakening in a... 相似文献
78.
Gianluca Occhetta 《manuscripta mathematica》2005,117(1):43-49
We rule out a doubtful case in the classification of Fano manifolds of middle indexMathematics Subject Classification (2000): 14J40, 14J45 相似文献
79.
Andrea Cappelli Maurizio Anzini Salvatore Vomero Alessandro Donati Lucia Zetta Raniero Mendichi Mario Casolaro Pietro Lupetti Paolo Salvatici Gianluca Giorgi 《Journal of polymer science. Part A, Polymer chemistry》2005,43(15):3289-3304
The macromolecular and aggregate structures of poly[ethyl 1‐methylene‐3‐(4‐methylphenyl)‐1H‐indene‐2‐carboxylate] (poly‐ BF1 ; a new polymer based on a functionalized benzofulvene moiety showing interesting properties, i.e., thermoreversible polymerization/depolymerization behavior, high solubility in the most common organic solvents, and susceptibility to molecular manipulation) have been investigated with NMR spectroscopy, absorption and emission spectrophotometry, and transmission electron microscopy (TEM). Moreover, the polymerization mechanism has been studied to obtain further information on the polymer structure. The collected evidence is consistent in indicating for poly‐ BF1 a vinyl (1,2) polymer structure stabilized by means of aromatic stacking interactions. Furthermore, TEM studies performed on metal replicas have shown that the polymer is liable to give nanostructured aggregates. © 2005 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 43: 3289–3304, 2005 相似文献
80.
In the field of the Jacobian conjecture it is well-known after Dru?kowski that from a polynomial ‘cubic-homogeneous’ mapping we can build a higher-dimensional ‘cubic-linear’ mapping and the other way round, so that one of them is invertible if and only if the other one is. We make this point clearer through the concept of ‘pairing’ and apply it to the related conjugability problem: one of the two maps is conjugable if and only if the other one is; moreover, we find simple formulas expressing the inverse or the conjugations of one in terms of the inverse or conjugations of the other. Two nontrivial examples of conjugable cubic-linear mappings are provided as an application. 相似文献