837 research outputs found

    Consciousness and the Wigner's friend problem

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    It is generally agreed that decoherence theory is, if not a complete answer, at least a great step forward towards a solution of the quantum measurement problem. It is shown here however that in the cases in which a sentient being is explicitly assumed to take cognizance of the outcome the reasons we have for judging this way are not totally consistent, so that the question has to be considered anew. It is pointed out that the way the Broglie-Bohm model solves the riddle suggests a possible clue, consisting in assuming that even very simple systems may have some sort of a proto-consciousness, but that their ``internal states of consciousness'' are not predictive. It is, next, easily shown that if we imagine the systems get larger, in virtue of decoherence their internal states of consciousness progressively gain in predictive value. So that, for macro-systems, they may be identified (in practice) with the predictive states of consciousness on which we ground our observational predictions. The possibilities of carrying over this idea to standard quantum mechanics are then investigated. Conditions of conceptual consistency are considered and found rather strict, and, finally, two solutions emerge, differing conceptually very much from one another but in both of which the, possibly non-predictive, generalized internal states of consciousness play a crucial role

    Elastic Correlations in Nucleosomal DNA Structure

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    The structure of DNA in the nucleosome core particle is studied using an elastic model that incorporates anisotropy in the bending energetics and twist-bend coupling. Using the experimentally determined structure of nucleosomal DNA [T.J. Richmond and C.A. Davey, Nature {\bf 423}, 145 (2003)], it is shown that elastic correlations exist between twist, roll, tilt, and stretching of DNA, as well as the distance between phosphate groups. The twist-bend coupling term is shown to be able to capture these correlations to a large extent, and a fit to the experimental data yields a new estimate of G=25 nm for the value of the twist-bend coupling constant

    Nonlinear Mechanical Response of DNA due to Anisotropic Bending Elasticity

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    The response of a short DNA segment to bending is studied, taking into account the anisotropy in the bending rigidities caused by the double-helical structure. It is shown that the anisotropy introduces an effective nonlinear twist-bend coupling that can lead to the formation of kinks and modulations in the curvature and/or in the twist, depending on the values of the elastic constants and the imposed deflection angle. The typical wavelength for the modulations, or the distance between the neighboring kinks is found to be set by half of the DNA pitch.Comment: 4 pages, 3 encapsulated EPS figure

    Heat conductivity of DNA double helix

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    Thermal conductivity of isolated single molecule DNA fragments is of importance for nanotechnology, but has not yet been measured experimentally. Theoretical estimates based on simplified (1D) models predict anomalously high thermal conductivity. To investigate thermal properties of single molecule DNA we have developed a 3D coarse-grained (CG) model that retains the realism of the full all-atom description, but is significantly more efficient. Within the proposed model each nucleotide is represented by 6 particles or grains; the grains interact via effective potentials inferred from classical molecular dynamics (MD) trajectories based on a well-established all-atom potential function. Comparisons of 10 ns long MD trajectories between the CG and the corresponding all-atom model show similar root-mean-square deviations from the canonical B-form DNA, and similar structural fluctuations. At the same time, the CG model is 10 to 100 times faster depending on the length of the DNA fragment in the simulation. Analysis of dispersion curves derived from the CG model yields longitudinal sound velocity and torsional stiffness in close agreement with existing experiments. The computational efficiency of the CG model makes it possible to calculate thermal conductivity of a single DNA molecule not yet available experimentally. For a uniform (polyG-polyC) DNA, the estimated conductivity coefficient is 0.3 W/mK which is half the value of thermal conductivity for water. This result is in stark contrast with estimates of thermal conductivity for simplified, effectively 1D chains ("beads on a spring") that predict anomalous (infinite) thermal conductivity. Thus, full 3D character of DNA double-helix retained in the proposed model appears to be essential for describing its thermal properties at a single molecule level.Comment: 16 pages, 12 figure

    Local Simulation Algorithms for Coulomb Interaction

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    Long ranged electrostatic interactions are time consuming to calculate in molecular dynamics and Monte-Carlo simulations. We introduce an algorithmic framework for simulating charged particles which modifies the dynamics so as to allow equilibration using a local Hamiltonian. The method introduces an auxiliary field with constrained dynamics so that the equilibrium distribution is determined by the Coulomb interaction. We demonstrate the efficiency of the method by simulating a simple, charged lattice gas.Comment: Last figure changed to improve demonstration of numerical efficienc
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