1,316 research outputs found

    Ab-initio self-energy corrections in systems with metallic screening

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    The calculation of self-energy corrections to the electron bands of a metal requires the evaluation of the intraband contribution to the polarizability in the small-q limit. When neglected, as in standard GW codes for semiconductors and insulators, a spurious gap opens at the Fermi energy. Systematic methods to include intraband contributions to the polarizability exist, but require a computationally intensive Fermi-surface integration. We propose a numerically cheap and stable method, based on a fit of the power expansion of the polarizability in the small-q region. We test it on the homogeneous electron gas and on real metals such as sodium and aluminum.Comment: revtex, 14 pages including 5 eps figures v2: few fixe

    A shared database of underground utility lines for 3D mapping and GIS applications

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    For the purpose of facility management it is very important to have detailed and up-to-date databases of underground utility lines, but such data are not always available with adequate accuracy. Hence, the need of collecting and organizing suitable information on underground services is a fundamental issue when dealing with urban data. Besides, by analyzing the process of designing and laying new underground infrastructures it is possible to implement an efficient and cost-effective approach to integrate and update existing maps by exploiting the surveying required for the installation of new facilities. It is also important to underline that collecting all the data in a unique integrated database (and GIS) gives the possibility to share (at least at a local level) the cartographic and thematic information for an optimal management of underground networks. In this paper, a database (DB) model for archiving the underground lines data is presented. The structure of the DB has been designed by following the standard methodology for the modelling of a relational DB, going through successive phases and originating the external, conceptual and logical model. Finally, preliminary tests have been carried on for parts of the DB to verify quality parameters

    Role of traditional and new biomarkers in breast carcinogenesis

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    In recent decades, several biomarkers have been investigated as predictors of breast cancer risk, development, prognosis and treatment efficacy

    Neutron activation analysis of archeological artifacts using the ISIS pulsed neutron source

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    Archeological artifacts can be analyzed after neutron irradiation at the pulsed ISIS neutron and muon source, UK, using a newly installed high purity germanium gamma ray spectrometer to perform neutron activation analysis. In this work, the details of the measurement methods and data analysis are presented. In particular, it is explained how Monte Carlo calculations are necessary to evaluate the detection efficiency, taking into account self-shielding effects. The results for two certified bronze standards are presented. The good agreement between expected and measured compositions is promising for the use of this technique for archeological artifacts where the elemental concentration is often unknown. As an example, the analysis of a Chinese sword from the first or second century BC is presented

    Transverse momentum dependent parton distributions in a light-cone quark model

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    The leading twist transverse momentum dependent parton distributions (TMDs) are studied in a light-cone description of the nucleon where the Fock expansion is truncated to consider only valence quarks. General analytic expressions are derived in terms of the six amplitudes needed to describe the three-quark sector of the nucleon light-cone wave function. Numerical calculations for the T-even TMDs are presented in a light-cone constituent quark model, and the role of the so-called pretzelosity is investigated to produce a nonspherical shape of the nucleon.Comment: references added and typos corrected; version to appear in Phys. Rev.

    Shaping and Dilating the Fitness Landscape for Parameter Estimation in Stochastic Biochemical Models

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    The parameter estimation (PE) of biochemical reactions is one of the most challenging tasks in systems biology given the pivotal role of these kinetic constants in driving the behavior of biochemical systems. PE is a non-convex, multi-modal, and non-separable optimization problem with an unknown fitness landscape; moreover, the quantities of the biochemical species appearing in the system can be low, making biological noise a non-negligible phenomenon and mandating the use of stochastic simulation. Finally, the values of the kinetic parameters typically follow a log-uniform distribution; thus, the optimal solutions are situated in the lowest orders of magnitude of the search space. In this work, we further elaborate on a novel approach to address the PE problem based on a combination of adaptive swarm intelligence and dilation functions (DFs). DFs require prior knowledge of the characteristics of the fitness landscape; therefore, we leverage an alternative solution to evolve optimal DFs. On top of this approach, we introduce surrogate Fourier modeling to simplify the PE, by producing a smoother version of the fitness landscape that excludes the high frequency components of the fitness function. Our results show that the PE exploiting evolved DFs has a performance comparable with that of the PE run with a custom DF. Moreover, surrogate Fourier modeling allows for improving the convergence speed. Finally, we discuss some open problems related to the scalability of our methodology

    Smart technologies for effective reconfiguration: the FASTER approach

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    Current and future computing systems increasingly require that their functionality stays flexible after the system is operational, in order to cope with changing user requirements and improvements in system features, i.e. changing protocols and data-coding standards, evolving demands for support of different user applications, and newly emerging applications in communication, computing and consumer electronics. Therefore, extending the functionality and the lifetime of products requires the addition of new functionality to track and satisfy the customers needs and market and technology trends. Many contemporary products along with the software part incorporate hardware accelerators for reasons of performance and power efficiency. While adaptivity of software is straightforward, adaptation of the hardware to changing requirements constitutes a challenging problem requiring delicate solutions. The FASTER (Facilitating Analysis and Synthesis Technologies for Effective Reconfiguration) project aims at introducing a complete methodology to allow designers to easily implement a system specification on a platform which includes a general purpose processor combined with multiple accelerators running on an FPGA, taking as input a high-level description and fully exploiting, both at design time and at run time, the capabilities of partial dynamic reconfiguration. The goal is that for selected application domains, the FASTER toolchain will be able to reduce the design and verification time of complex reconfigurable systems providing additional novel verification features that are not available in existing tool flows

    Biochemical parameter estimation vs. benchmark functions: A comparative study of optimization performance and representation design

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    © 2019 Elsevier B.V. Computational Intelligence methods, which include Evolutionary Computation and Swarm Intelligence, can efficiently and effectively identify optimal solutions to complex optimization problems by exploiting the cooperative and competitive interplay among their individuals. The exploration and exploitation capabilities of these meta-heuristics are typically assessed by considering well-known suites of benchmark functions, specifically designed for numerical global optimization purposes. However, their performances could drastically change in the case of real-world optimization problems. In this paper, we investigate this issue by considering the Parameter Estimation (PE) of biochemical systems, a common computational problem in the field of Systems Biology. In order to evaluate the effectiveness of various meta-heuristics in solving the PE problem, we compare their performance by considering a set of benchmark functions and a set of synthetic biochemical models characterized by a search space with an increasing number of dimensions. Our results show that some state-of-the-art optimization methods – able to largely outperform the other meta-heuristics on benchmark functions – are characterized by considerably poor performances when applied to the PE problem. We also show that a limiting factor of these optimization methods concerns the representation of the solutions: indeed, by means of a simple semantic transformation, it is possible to turn these algorithms into competitive alternatives. We corroborate this finding by performing the PE of a model of metabolic pathways in red blood cells. Overall, in this work we state that classic benchmark functions cannot be fully representative of all the features that make real-world optimization problems hard to solve. This is the case, in particular, of the PE of biochemical systems. We also show that optimization problems must be carefully analyzed to select an appropriate representation, in order to actually obtain the performance promised by benchmark results
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