258 research outputs found

    Protein sequence and structure: Is one more fundamental than the other?

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    We argue that protein native state structures reside in a novel "phase" of matter which confers on proteins their many amazing characteristics. This phase arises from the common features of all globular proteins and is characterized by a sequence-independent free energy landscape with relatively few low energy minima with funnel-like character. The choice of a sequence that fits well into one of these predetermined structures facilitates rapid and cooperative folding. Our model calculations show that this novel phase facilitates the formation of an efficient route for sequence design starting from random peptides.Comment: 7 pages, 4 figures, to appear in J. Stat. Phy

    Origin of Nonuniversality in Micellar Solutions: Comment

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    Rhynchospora caucasica Palla (Cyperaceae) Doğu Karadeniz'de, Rize'den tespit edilmiş ve Türkiye florası için yeni bir tür kaydı olarak verilmiştir. Taksonun betimi ve coğrafik dağılımı belirtilmiş, yakın akrabaları olan R. rugosa (Vahl) Gale subsp. rugosa ve R. rugosa (Vahl) Gale subsp. brownii (Roemer & Schultes) T.Koyama taksonları ile karşılaştırılmıştırR. caucasica Palla (Cyperaceae) is reported as a new record for Turkish flora in Rize province, NE Anatolia, Turkey. The description and distribution of the species are given. Also, it is compared with related taxa R. rugosa (Vahl) Gale subsp. rugosa and R. rugosa subsp. brownii (Roemer & Schultes) T. Koyam

    Correlations in Systems of Complex Directed Macromolecules

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    An ensemble of directed macromolecules on a lattice is considered, where the constituting molecules are chosen as a random sequence of N different types. The same type of molecules experiences a hard-core (exclusion) interaction. We study the robustness of the macromolecules with respect to breaking and substituting individual molecules, using a 1/N expansion. The properties depend strongly on the density of macromolecules. In particular, the macromolecules are robust against breaking and substituting at high densities.Comment: 9 pages, 4 figure

    Random-Anisotropy-Axis Magnet With Infinite Anisotropy

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    We have studied the random-axis magnet with infinite anisotropy by three methods: Cayley-tree approximation, Migdal-Kadanoff renormalization group (MKRG), and Imry-Ma scaling. In the Cayley-tree approximation, by an examination of susceptibilities, it is shown that there exists a competition between the coordination number z and the number of components n of the spins which leads to either ferromagnetic or spin-glass order. Using the MKRG at very low temperature we map out approximately the regimes of the ferromagnetic, spin-glass, and disordered phases as a function of n and the spatial dimension, d. The Imry-Ma arguments are made as an additional method for obtaining information on the critical dimension. Comparisons of these results with the previous literature are made

    Quantum Annealing Applied to De-Conflicting Optimal Trajectories for Air Traffic Management

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    We present the mapping of a class of simplified air traffic management (ATM) problems (strategic conflict resolution) to quadratic unconstrained boolean optimization (QUBO) problems. The mapping is performed through an original representation of the conflict-resolution problem in terms of a conflict graph, where nodes of the graph represent flights and edges represent a potential conflict between flights. The representation allows a natural decomposition of a real world instance related to wind-optimal trajectories over the Atlantic ocean into smaller subproblems, that can be discretized and are amenable to be programmed in quantum annealers. In the study, we tested the new programming techniques and we benchmark the hardness of the instances using both classical solvers and the D-Wave 2X and D-Wave 2000Q quantum chip. The preliminary results show that for reasonable modeling choices the most challenging subproblems which are programmable in the current devices are solved to optimality with 99% of probability within a second of annealing time.Comment: Paper accepted for publication on: IEEE Transactions on Intelligent Transportation System

    Minimal H\"older regularity implying finiteness of integral Menger curvature

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    We study two families of integral functionals indexed by a real number p>0p > 0. One family is defined for 1-dimensional curves in R3\R^3 and the other one is defined for mm-dimensional manifolds in Rn\R^n. These functionals are described as integrals of appropriate integrands (strongly related to the Menger curvature) raised to power pp. Given p>m(m+1)p > m(m+1) we prove that C1,αC^{1,\alpha} regularity of the set (a curve or a manifold), with α>α0=1m(m+1)p\alpha > \alpha_0 = 1 - \frac{m(m+1)}p implies finiteness of both curvature functionals (m=1m=1 in the case of curves). We also show that α0\alpha_0 is optimal by constructing examples of C1,α0C^{1,\alpha_0} functions with graphs of infinite integral curvature

    Discrete energy landscapes and replica symmetry breaking at zero temperature

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    The order parameter P(q) for disordered systems with degenerate ground-states is reconsidered. We propose that entropy fluctuations lead to a trivial P(q) at zero temperature as in the non-degenerate case, even if there are zero-energy large-scale excitations (complex energy landscape). Such a situation should arise in the 3-dimensional +-J Ising spin glass and in MAX-SAT. Also, we argue that if the energy landscape is complex with a finite number of ground-state families, then replica symmetry breaking reappears at positive temperature.Comment: 7 pages; clarifications on valley definition

    Nanoscale fluid flows in the vicinity of patterned surfaces

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    Molecular dynamics simulations of dense and rarefied fluids comprising small chain molecules in chemically patterned nano-channels predict a novel switching from Poiseuille to plug flow along the channel. We also demonstrate behavior akin to the lotus effect for a nanodrop on a chemically patterned substrate. Our results show that one can control and exploit the behavior of fluids at the nanoscale using chemical patterning.Comment: Phys. Rev. Lett. in pres

    Identification of Flights for Cost-Efficient Climate Impact Reduction

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    The aircraft-induced climate impact has drawn attention in recent years. Aviation operations affect the environment mainly through the release of carbon-dioxide, nitrogen-oxides, and by the formation of contrails. Recent research has shown that altering trajectories can reduce aviation environmental cost by reducing Absolute Global Temperature Change Potential, a climate assessment metric that adapts a linear system for modeling the global temperature response to aviation emissions and contrails. However, these methods will increase fuel consumption that leads to higher fuel costs imposed on airlines. The goal of this work is to identify ights for which the environmental cost of climate impact reduction outweighs the increase in operational cost on an individual aircraft basis. Environmental cost is quanti ed using the monetary social cost of carbon. The increase in operational cost is considering cost of additional fuel usage only. For this paper, an algorithm has been developed that modi es the trajectories of ights to evaluate the e ect of environ- mental cost and operational cost of ights in the United States National Airspace System. The algorithm identi es ights for which the environmental cost of climate impact can be reduced and modi es their trajectories to achieve maximum environmental net bene t, which is the di erence between reduction in environmental cost and additional operational cost. The result shows on a selected day, 16% of the ights among eight major airlines, or 2,043 ights, can achieve environmental net bene t using weather forecast data, resulting in net bene t of around $500,000. The result also suggests that the long-haul ights would be better candidates for cost-ecient climate impact reduction than the short haul ights. The algorithm will help to identify the characteristics of ights that are capable of applying cost-ecient climate impact reduction strategy
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