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  • 1
    Electronic Resource
    Electronic Resource
    New York, NY : Wiley-Blackwell
    Proteins: Structure, Function, and Genetics 33 (1998), S. 145-158 
    ISSN: 0887-3585
    Keywords: protein titration ; molecular dynamics ; average conformation ; continuum electrostatistics ; protein dielectric constant ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Medicine
    Notes: Several methods for including the conformational flexibility of proteins in the calculation of titration curves are compared. The methods use the linearized Poisson-Boltzmann equation to calculate the electrostatic free energies of solvation and are applied to bovine pancreatic trypsin inhibitor (BPTI) and hen egg-white lysozyme (HEWL). An ensemble of conformations is generated by a molecular dynamics simulation of the proteins with explicit solvent. The average titration curve of the ensemble is calculated in three different ways: an average structure is used for the pKa calculation; the electrostatic interaction free energies are averaged and used for the pKa calculation; and the titration curve for each structure is calculated and the curves are averaged. The three averaging methods give very similar results and improve the pKa values to approximately the same degree. This suggests, in contrast to implications from other work, that the observed improvement of pKa values in the present studies is due not to averaging over an ensemble of structures, but rather to the generation of a single properly averaged structure for the pKa calculation. Proteins 33:145-158, 1998. © 1998 Wiley-Liss, Inc.
    Additional Material: 4 Ill.
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  • 2
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Particle and Particle Systems Characterization 6 (1989), S. 81-85 
    ISSN: 0934-0866
    Keywords: Chemistry ; Industrial Chemistry and Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: This Committee stood under the banner of joint meetings with the Crystallization Committee. Further it was characterized by two aspects, namely technological innovation in connection with measurement methods and their (on-line) application in engineering processes, whether for the sake of model formation or for process control or quality assurance in industry.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Particle and Particle Systems Characterization 8 (1991), S. 1-7 
    ISSN: 0934-0866
    Keywords: Chemistry ; Industrial Chemistry and Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Describing the disperse state is important for quality assurance, operational safety and the design and modelling of processes, especially in solids technology. Starting materials, intermediates and end products have to be characterized. Apart from representative sampling, preparation greatly influences the results of particle characterization. Very fine particles are normally agglomerated unless a highly dispersed state is stabilized by an additive. For a meaningful measurement, they must be preserved in this state or be definitely dispersed, depending on the type of problem.If the point of interest is the present disperse state with regard to the processing characteristics, e.g. for a filtration, the system should not be changed by the preparation method. If it is necessary to determine the property functions, i. e. the functional relationship between technological and physical properties, it is necessary in general to use a high dispersion energy or a long dispersing time in order to obtain the best achievable dispersion. The finer and more unstable a disperse phase is, the more the correct processing is important for the result. The problems of dispersion in gases and liquids are discussed with some examples.
    Additional Material: 13 Ill.
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  • 4
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Particle and Particle Systems Characterization 4 (1987), S. 166-174 
    ISSN: 0934-0866
    Keywords: Chemistry ; Industrial Chemistry and Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: Double pulse holography is, for experimental investigations, an extremely valuable means of measuring transport processes in disperse phases. This method allows the single or two dimensional frequency distributions of particle size, velocity, momentum and energy to be determined for each recorded sub-collective, with the additional possibility of checking the existence of their correlation. Being an imaging method, the distributions of the particles in space can be displayed along with the instantaneous values of the concentration and particle flux density.A complete and very exact evaluation of the holographic images, coupled with the certainty of image pairing, is one of the prerequisites of a successful application. The best evaluation in this sense is, at present, produced by a semi-automatic, interactive system in which the assessment of certain crucial factors is left to an operator.Although the effort incurred by such a total evaluation is by no means insignificant, it is justified by the profusion of information to be obtained.The present report explains the whole concept including a programme system with which the primary data is further processed and with which a variety of results may be called up and displayed.
    Additional Material: 12 Ill.
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Particle and Particle Systems Characterization 4 (1987), S. 1-6 
    ISSN: 0934-0866
    Keywords: Chemistry ; Industrial Chemistry and Chemical Engineering
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Mechanical Engineering, Materials Science, Production Engineering, Mining and Metallurgy, Traffic Engineering, Precision Mechanics , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A comprehensive description of gas-particle flows requires the knowledge of the distribution states of the particulate phase. To determine these distribution states in the first instance, optical methods are suitable, in particular double pulse holography. It yields a maximum amount of information, because as an imaging method it allows the determination of position, size and velocity of each individual particle of a collective simultaneously. The consequence is that the spatial distribution of the particles can be determined, as well as the frequency distributions of all the relevant quantities, such as diameter, velocity, momentum and energy as well as their local dependence and correlation. In the present case double pulse holography was employed to study different gas-particle flows at the outlet of a vertical tube (length 1 m, diameter 50 mm, mean gas velocity 3 m/s, Re = 10000). The dispersed phases consisted of water droplets with a broad size spectrum from 3 to 100 m̈m, and of glass spheres ranging from 20 to 35 μm.The most important results which are discussed in this paper are: 1the local dependence of concentration, mean size and mean particle velocity,2the frequency distributions of particle size and velocity,3the distributions of energy and momentum as function of particle size,4the correlation of particle velocity with particle size.The results reflect the different behaviour of the two particulate phases used.
    Additional Material: 15 Ill.
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  • 6
    Electronic Resource
    Electronic Resource
    Hoboken, NJ : Wiley-Blackwell
    Journal of Biomedical Materials Research 29 (1995), S. 337-347 
    ISSN: 0021-9304
    Keywords: Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Medicine , Technology
    Notes: As part of ongoing studies in polyurethane biostability and biodegradation, we have investigated an in vitro system to test strained poly(etherurethane urea) (PEUU). Recently, we utilized this system to reproduce in vivo stress cracking in strained Pellethane®. In this study, strained PEUU was tested to determine whether it degrades through a common mechanism with Pellethane® and to further examine the steps involved in this degradation.Biaxially strained PEUU elastomers were treated with an α2-macroglobulin (α2-Mac) protein solution followed by an oxidative H2O2/CoCl2 treatment. Characterization of the strained PEUU specimens was performed with attenuated total reflectance-Fourier transform infrared spectroscopy, scanning electron microscopy (SEM), electron spectroscopy for chemical analysis, and contact angle analysis. The results from these characterization techniques provide conclusive evidence that biodegradation of PEUU and Pellethane® occurs through a common mechanism. Chemical changes to the PEUU include cleavage of the polyether soft segments and urethane linkages, leaving the hard segment domains unaffected. SEM analysis shows that this chain cleavage leads to the development of severe pitting and cracking of the PEUU surface. In addition, the in vitro degradation accurately reproduces the in vivo degradation chemically and physically. This result verifies that the primary species responsible for biodegradation of PEUUs, in vivo, are hydroxyl and/or hydroperoxide radicals. α2-Mac pretreatment increases the rate of degradation compared to direct treatment in H2O2/CoCl2. As the PEUU soft segment chains are cleaved, the degradation products are extracted into the treatment solution or environment. Finally, a new biodegradation mechanism of PEUUs is presented that involves crosslinking of the polyether soft segments. © 1995 John Wiley & Sons, Inc.
    Additional Material: 9 Ill.
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  • 7
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Chemie Ingenieur Technik - CIT 58 (1986), S. 895-897 
    ISSN: 0009-286X
    Keywords: Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Additional Material: 5 Ill.
    Type of Medium: Electronic Resource
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  • 8
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Chemie Ingenieur Technik - CIT 71 (1999), S. 966-967 
    ISSN: 0009-286X
    Keywords: Chemistry ; Industrial Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Process Engineering, Biotechnology, Nutrition Technology
    Type of Medium: Electronic Resource
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  • 9
    ISSN: 0044-8249
    Keywords: Chemistry ; General Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Additional Material: 4 Ill.
    Type of Medium: Electronic Resource
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  • 10
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Zeitschrift für anorganische Chemie 614 (1992), S. 21-24 
    ISSN: 0044-2313
    Keywords: Trichloro(15-crown-6)tellurium hexachloroantimonate ; preparation, crystal structure ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Description / Table of Contents: The Crystal Structure of [TeCl3(15-crown-5)]SbCl6The title compound is synthesized by the reaction of tellur tetrachloride, 15-crown-5 and antimony pentachloride in acetonitrile solution, forming colourless crystals, which were characterized by IR spectroscopy and an X-ray structure determination. Space group Pnma, Z = 4, 1966 observed unique reflections, R = 0.072, Rw = 0.052. The compound forms ions [TeCl3(15-crown-5)]+ and SbCl6-; in the cation the tellurium atom is eightfold coordinated by the three chlorine atoms and the five oxygen atoms of the crownether molecule (Te—O bond lengths 266 and 279 pm).
    Notes: Die Titelverbindung entsteht aus Tellurtetrachlorid, Antimonpentachlorid und 15-Krone-5 in Acetonitrillösung in Form farbloser Kristalle, die durch das IR-Spektrum und eine röntgenographische Strukturanalyse charakterisiert werden. Raumgruppe Pnma, Z = 4, 1966 beobachtete Reflexe, R = 7,2%, Rw = 5,2%. Die Verbindung bildet Ionen [TeCl3(15-Krone-5)]+ und SbCl6-; im Kation ist das Telluratom achtfach durch die drei Chloratome und die fünf O-Atome des Kronenethers koordiniert (Te—O-Abstände 266 und 279 pm).
    Additional Material: 2 Ill.
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