898 research outputs found

    The Full Wealth of Conviction and Cognition: Psychology\'s Modernist Critique of Fundamentalism in Postmodern Perspective

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    The author draws parallels between psychology and religious modernism as exemplified in the writings of such figures as Harry Emerson Fosdick. Miller suggests that psychological research arguing that fundamentalists are \"cognitivcly challenged\" is more reflective of psychology\'s unacknowledged modernist assumptions than descriptive of fundamentalists. A post-modernist recognition of psychology\'s bias should help redirect efforts toward understanding fundamentalists\' pressing desire to preserve a particular orderly culture

    DNA double helices for single molecule electronics

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    The combination of self-assembly and electronic properties as well as its true nanoscale dimensions make DNA a promising candidate for a building block of single molecule electronics. We argue that the intrinsic double helix conformation of the DNA strands provides a possibility to drive the electric current through the DNA by the perpendicular electric (gating) field. The transistor effect in the poly(G)-poly(C) synthetic DNA is demonstrated within a simple model approach. We put forward experimental setups to observe the predicted effect and discuss possible device applications of DNA. In particular, we propose a design of the single molecule analog of the Esaki diode.Comment: 4 pages, 4 figur

    Study of a model for the folding of a small protein

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    We describe the results obtained from an improved model for protein folding. We find that a good agreement with the native structure of a 46 residue long, five-letter protein segment is obtained by carefully tuning the parameters of the self-avoiding energy. In particular we find an improved free-energy profile. We also compare the efficiency of the multidimensional replica exchange method with the widely used parallel tempering.Comment: typos corrected, one figure adde

    Some Fundamental Properties of a Multivariate von Mises Distribution

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    In application areas like bioinformatics multivariate distributions on angles are encountered which show significant clustering. One approach to statistical modelling of such situations is to use mixtures of unimodal distributions. In the literature (Mardia et al., 2011), the multivariate von Mises distribution, also known as the multivariate sine distribution, has been suggested for components of such models, but work in the area has been hampered by the fact that no good criteria for the von Mises distribution to be unimodal were available. In this article we study the question about when a multivariate von Mises distribution is unimodal. We give sufficient criteria for this to be the case and show examples of distributions with multiple modes when these criteria are violated. In addition, we propose a method to generate samples from the von Mises distribution in the case of high concentration.Comment: fixed a typo in the article title, minor fixes throughou

    Helical states of nonlocally interacting molecules and their linear stability: geometric approach

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    The equations for strands of rigid charge configurations interacting nonlocally are formulated on the special Euclidean group, SE(3), which naturally generates helical conformations. Helical stationary shapes are found by minimizing the energy for rigid charge configurations positioned along an infinitely long molecule with charges that are off-axis. The classical energy landscape for such a molecule is complex with a large number of energy minima, even when limited to helical shapes. The question of linear stability and selection of stationary shapes is studied using an SE(3) method that naturally accounts for the helical geometry. We investigate the linear stability of a general helical polymer that possesses torque-inducing non-local self-interactions and find the exact dispersion relation for the stability of the helical shapes with an arbitrary interaction potential. We explicitly determine the linearization operators and compute the numerical stability for the particular example of a linear polymer comprising a flexible rod with a repeated configuration of two equal and opposite off-axis charges, thereby showing that even in this simple case the non-local terms can induce instability that leads to the rod assuming helical shapes.Comment: 34 pages, 9 figure

    Elastic energy of proteins and the stages of protein folding

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    We propose a universal elastic energy for proteins, which depends only on the radius of gyration RgR_{g} and the residue number NN. It is constructed using physical arguments based on the hydrophobic effect and hydrogen bonding. Adjustable parameters are fitted to data from the computer simulation of the folding of a set of proteins using the CSAW (conditioned self-avoiding walk) model. The elastic energy gives rise to scaling relations of the form RgNνR_{g}\sim N^{\nu} in different regions. It shows three folding stages characterized by the progression with exponents ν=3/5,3/7,2/5\nu = 3/5, 3/7, 2/5, which we identify as the unfolded stage, pre-globule, and molten globule, respectively. The pre-globule goes over to the molten globule via a break in behavior akin to a first-order phase transition, which is initiated by a sudden acceleration of hydrogen bonding

    A systematically coarse-grained model for DNA, and its predictions for persistence length, stacking, twist, and chirality

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    We introduce a coarse-grained model of DNA with bases modeled as rigid-body ellipsoids to capture their anisotropic stereochemistry. Interaction potentials are all physicochemical and generated from all-atom simulation/parameterization with minimal phenomenology. Persistence length, degree of stacking, and twist are studied by molecular dynamics simulation as functions of temperature, salt concentration, sequence, interaction potential strength, and local position along the chain, for both single- and double-stranded DNA where appropriate. The model of DNA shows several phase transitions and crossover regimes in addition to dehybridization, including unstacking, untwisting, and collapse which affect mechanical properties such as rigidity and persistence length. The model also exhibits chirality with a stable right-handed and metastable left-handed helix.Comment: 30 pages, 20 figures, Supplementary Material available at http://www.physics.ubc.ca/~steve/publications.htm
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