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  • Chemistry  (8)
  • information-based measures  (2)
  • 06A12  (1)
  • 1
    Electronic Resource
    Electronic Resource
    Springer
    Order 10 (1993), S. 105-110 
    ISSN: 1572-9273
    Keywords: 06A07 ; 06A12 ; 05E25 ; 20B25 ; Automorphism ; isotone self-map ; irreducible element
    Source: Springer Online Journal Archives 1860-2000
    Topics: Mathematics
    Notes: Abstract For an ordered setP letP P denote the set of all isotone self-maps on P, that is, all mapsf fromP toP such thatx≥y impliesf(x)≥f(y), and let Aut (P) the set of all automorphisms onP, that is, all bijective isotone self-maps inP P . We establish an inequality relating ¦P P ¦ and ¦Aut(P)¦ in terms of the irreducibles ofP. As a straightforward corollary, we show that Rival and Rutkowski's automorphism conjecture is true for lattices. It is also true for ordered sets with top and bottom whose covering graphs are planar.
    Type of Medium: Electronic Resource
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  • 2
    Electronic Resource
    Electronic Resource
    Springer
    Machine learning 15 (1994), S. 321-329 
    ISSN: 0885-6125
    Keywords: Decision trees ; noise ; induction ; unbiased attribute selection ; information-based measures
    Source: Springer Online Journal Archives 1860-2000
    Topics: Computer Science
    Notes: Abstract A fresh look is taken at the problem of bias in information-based attribute selection measures, used in the induction of decision trees. The approach uses statistical simulation techniques to demonstrate that the usual measures such as information gain, gain ratio, and a new measure recently proposed by Lopez de Mantaras (1991) are all biased in favour of attributes with large numbers of values. It is concluded that approaches which utilise the chi-square distribution are preferable because they compensate automatically for differences between attributes in the number of levels they take.
    Type of Medium: Electronic Resource
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  • 3
    Electronic Resource
    Electronic Resource
    Springer
    Machine learning 15 (1994), S. 321-329 
    ISSN: 0885-6125
    Keywords: Decision trees ; noise ; induction ; unbiased attribute selection ; information-based measures
    Source: Springer Online Journal Archives 1860-2000
    Topics: Computer Science
    Notes: Abstract A fresh look is taken at the problem of bias in information-based attribute selection measures, used in the induction of decision trees. The approach uses statistical simulation techniques to demonstrate that the usual measures such as information gain, gain ratio, and a new measure recently proposed by Lopez de Mantaras (1991) are all biased in favour of attributes with large numbers of values. It is concluded that approaches which utilise the chi-square distribution are preferable because they compensate automatically for differences between attributes in the number of levels they take.
    Type of Medium: Electronic Resource
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  • 4
    Electronic Resource
    Electronic Resource
    New York : Wiley-Blackwell
    Biopolymers 27 (1988), S. 1641-1654 
    ISSN: 0006-3525
    Keywords: Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Weight-average molecular weights Mw, second virial coefficients, and z-average radii of gyration 〈S2〉1/2z were determined by light scattering as a function of temperature T for four sodium salt samples of xanthan in 0.01M aqueous NaCl, in which the polysaccharide undergoes an order-disorder conformation change with increasing T. The data for 〈S2〉1/2z and Mw at 25 and 80°C, the lowest and highest temperatures studied, confirmed the previous conclusion that the predominant conformation at the former T, i.e., in the ordered state, is a double helix, while that at the latter T, i.e., in the disordered state, is a dimerized coil expanded by electrostatic repulsions between charged groups of the polymer. As T was increased from 25 to 80°C, 〈S2〉1/2z sigmoidally decreased or increased depending on the dimer's molecular weight. This temperature dependence of 〈S2〉1/2z and that determined elsewhere for a high molecular weight sample were found to be described almost quantitatively by a simple dimer model in which the double helix melts from both ends, when the double-helical fraction in the dimer at a given T estimated previously from optical rotation data was used.
    Additional Material: 7 Ill.
    Type of Medium: Electronic Resource
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  • 5
    Electronic Resource
    Electronic Resource
    New York, NY : Wiley-Blackwell
    Proteins: Structure, Function, and Genetics 31 (1998), S. 97-103 
    ISSN: 0887-3585
    Keywords: α domains ; β domains ; α/β domains ; α+β domains ; resubstitution ; jackknife ; SCOP database ; Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Medicine
    Notes: Can the coupling effect among different amino acid components be used to improve the prediction of protein structural classes? The answer is yes according to the study by Chou and Zhang (Crit. Rev. Biochem. Mol. Biol. 30:275-349, 1995), but a completely opposite conclusion was drawn by Eisenhaber et al. when using a different dataset constructed by themselves (Proteins 25:169-179, 1996). To resolve such a perplexing problem, predictions were performed by various approaches for the datasets from an objective database, the SCOP database (Murzin, Brenner, Hubbard, and Chothia. J. Mol. Biol. 247:536-540, 1995). According to SCOP, the classification of structural classes for protein domains is based on the evolutionary relationship and on the principles that govern the 3D structure of proteins, and hence is more natural and reliable. The results from both resubstitution tests and jackknife tests indicate that the overall rates of correct prediction by the algorithm incorporated with the coupling effect among different amino acid components are significantly higher than those by the algorithms without using such an effect. It is elucidated through an analysis that the main reasons for Eisenhaber et al. to have reached an opposite conclusion are the result of (1) misusing the component-coupled algorithm, and (2) using a conceptually incorrect rule to classify protein structural classes. The formulation and analysis presented in this article are conducive to clarify these problems, helping correctly to apply the prediction algorithm and interpret the results. Proteins 31:97-103, 1998. © 1998 Wiley-Liss, Inc.
    Additional Material: 4 Tab.
    Type of Medium: Electronic Resource
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  • 6
    Electronic Resource
    Electronic Resource
    Bognor Regis [u.a.] : Wiley-Blackwell
    Journal of Polymer Science Part A: Polymer Chemistry 36 (1998), S. 2899-2903 
    ISSN: 0887-624X
    Keywords: cationic ring-opening polymerization ; poly(1,3-dioxepane) triol ; 2,2-bis(hydroxymethyl)butanol ; transacetalization ; activated monomer mechanism ; activated chain mechanism ; Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Cationic polymerization of 1,3-dioxepane (DOP) initiated by triflic acid was carried out in the presence of 2,2-bis(hydroxymethyl)butanol (BHMB). The structure and molecular weight of the products were characterized by GPC and NMR spectra. The results showed that molecular weight of the polyacetal obtained could be controlled by the initial mole ratio of DOP/BHMB. GPC showed that as the mole ratio of BHMB/DOP increased, the content of cyclic oligomers also increased. Proton, 13C and 2D HMQC-fg NMR demonstrated that no hydroxymethyl group of BHMB appeared as an end group. It was also illustrated by proton NMR that some BHMB units existed in cyclic oligomers. The mechanism of formation of cyclic oligomers was discussed. © 1998 John Wiley & Sons, Inc. J Polym Sci A: Polym Chem 36: 2899-2903, 1998
    Additional Material: 4 Ill.
    Type of Medium: Electronic Resource
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  • 7
    Electronic Resource
    Electronic Resource
    New York, NY [u.a.] : Wiley-Blackwell
    Biotechnology and Bioengineering 35 (1990), S. 185-194 
    ISSN: 0006-3592
    Keywords: Chemistry ; Biochemistry and Biotechnology
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Biology , Process Engineering, Biotechnology, Nutrition Technology
    Notes: A mathematical model of the tryptophan operon is analyzed to investigate the regulatory effects of feedback repression and the demand for tryptophan in the cell. In this model, feedback repression is considered to be a two-step process. First, the endproduct tryptophan combines with the inactive repressor produced by the regulatory genes to yield an active complex. This complex subsequently binds to the operator and prevents transcription of the structural genes into mRNA. The demand for tryptophan in the cell is modeled by a hyperbolic saturation function of the Michaelis-Menten type. Results are obtained for the expression of the tryptophan operon in Escherichia coli and their applicability to tryptophan production by microbial fermentation is discussed. It is shown that, depending on the strain level of the operon and the rate of utilization of tryptophan in the cell, an overproduction of tryptophan can be achieved under stable operating conditions; in other circumstances, the operon may become stable or unstable, and may lead to a periodic synthesis.
    Additional Material: 5 Ill.
    Type of Medium: Electronic Resource
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  • 8
    Electronic Resource
    Electronic Resource
    Chichester : Wiley-Blackwell
    Journal of Physical Organic Chemistry 11 (1998), S. 397-406 
    ISSN: 0894-3230
    Keywords: bond dissociation energy ; acidity ; phenylsulfenylamides ; phenylsulfenylanilides ; Chemistry ; Theoretical, Physical and Computational Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology , Physics
    Notes: Acidities and bond dissociation energies (BDEs) of the N-H bond in two phenylsulfenylamides, PhSNHBz and PhSNH-t-Bu, and four phenylsulfenylanilides, 4-GC6H4NHSPh, where G  =  MeO, H, Br and CN, were measured in order to compare the effects of substituents on acidities and BDEs of N - H bonds with those of C - H bonds. The effects of PhS groups on acidities and BDEs in a series of C - H acids were found to be comparable to those on acidities and BDEs of PhS in a similar series of N - H acids. Comparisons were also made of the effects of changing the oxidation state of sulfur in the series PhS, PhSO and PhSO2 on the acidities and BDEs of adjacent N - H and C - H bonds in weak acids. Hammett-type plots of pKHA values for phenyl benzyl sulfones (4-GC6H4CH2SO2Ph) and phenylsulfenylanilides (4-GC6H4NHSPh) were linear vs σp- values. A linear plot was obtained and explained for a plot of BDE of the N - H bonds in remotely substituted phenylsulfonylanilides with σ+ values. Plots of BDEs vs Eox(A-) were also linear for 4-substituted phenylsulfenylanilides (4-GC6H4NHSPh), phenylsulfonylanilides (4-GC6H4NHSO2Ph) and phenyl benzyl sulfones (4-GC6H4CH2SO2Ph). © 1998 John Wiley & Sons, Ltd.
    Additional Material: 7 Tab.
    Type of Medium: Electronic Resource
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  • 9
    ISSN: 1434-1948
    Keywords: Rare earth complexes ; Naphthalocyaninato ligand ; Double-decker complexes ; Chemistry ; General Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: A series of rare earth(III) double-deckers RE[Nc(tBu)4]2 [RE = La, Ce, Pr, Nd, Eu, Gd, Tb, Y, Er; Nc(tBu)4 = dianion of tetra(tert-butyl)-2,3-naphthalocyanine] (1-9) have been prepared by treating RE(acac)3·n H2O (acac = acetylacetonate) with 6-tert-butylnaphthalonitrile in refluxing n-octanol in the presence of 1,8-diazabicyclo[5.4.0]undec-7-ene (DBU). These novel sandwich-type complexes have been spectroscopically characterized. The electrochemical studies show that the first oxidation and the first reduction potentials increase with the size of the central metal ions with a relatively small separation (0.28-0.33 V), reflecting the narrow HOMO-LUMO gap.
    Additional Material: 5 Ill.
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  • 10
    ISSN: 0006-3525
    Keywords: Chemistry ; Polymer and Materials Science
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Six samples of Na xanthan in 0.01M aqueous NaCl containing 0.01 N HCl (pH = 2) were studied by light scattering and viscosity. This study was motivated by the finding that the intrinsic viscosity [η] fairly sharply decreased when the pH of the solvent was lowered from about 6 to 2 by adding HCl to 0.01M aqueous NaCl in which Na xanthan dissolves as rigid dimers having a double-helical structure. The data for weight-average molecular weight, radius of gyration, and [η] showed that Na xanthan at pH = 2 remains a dimer behaving as a semiflexible chain. Data analysis in terms of known theories for unperturbed wormlike chains yielded 0.47 ± 0.02, 2.0 ± 0.6, and 68 ± 7 nm for the contour length h per main-chain residue, diameter d, and persistence length q of the dimer, respectively. these h and d values agreed with the pitch per main-chain residue and the diameter of the double helix of Na xanthan in 0.01 or 0.1M aqueous NaCl. However, the q value, which was close to the intrinsic persistence length q0 ( = q in the absence of electrostatic interaction) of Na xanthan at pH = 2, was much smaller than the q0 (106 nm) of this helix. We concluded that the xanthan dimer at pH = 2 assumes a double-helical structure, which is geometrically the same as, but is more flexible than, that at neutral pH.
    Additional Material: 5 Ill.
    Type of Medium: Electronic Resource
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