Search results for "Computation"
showing 10 items of 7362 documents
Improving computation efficiency using input and architecture features for a virtual screening application
2023
Virtual screening is an early stage of the drug discovery process that selects the most promising candidates. In the urgent computing scenario it is critical to find a solution in a short time frame. In this paper, we focus on a real-world virtual screening application to evaluate out-of-kernel optimizations, that consider input and architecture features to improve the computation efficiency on GPU. Experiment results on a modern supercomputer node show that we can almost double the performance. Moreover, we implemented the optimization using SYCL and it provides a consistent benefit with the CUDA optimization. A virtual screening campaign can use this gain in performance to increase the nu…
Seam Puckering Objective Evaluation Method for Sewing Process
2015
The paper presents an automated method for the assessment and classification of puckering defects detected during the preproduction control stage of the sewing machine or product inspection. In this respect, we have presented the possible causes and remedies of the wrinkle nonconformities. Subjective factors related to the control environment and operators during the seams evaluation can be reduced using an automated system whose operation is based on image processing. Our implementation involves spectral image analysis using Fourier transform and an unsupervised neural network, the Kohonen Map, employed to classify material specimens, the input images, into five discrete degrees of quality…
Reduced Order Models for Pricing European and American Options under Stochastic Volatility and Jump-Diffusion Models
2016
European options can be priced by solving parabolic partial(-integro) differential equations under stochastic volatility and jump-diffusion models like the Heston, Merton, and Bates models. American option prices can be obtained by solving linear complementary problems (LCPs) with the same operators. A finite difference discretization leads to a so-called full order model (FOM). Reduced order models (ROMs) are derived employing proper orthogonal decomposition (POD). The early exercise constraint of American options is enforced by a penalty on subset of grid points. The presented numerical experiments demonstrate that pricing with ROMs can be orders of magnitude faster within a given model p…
Modeling Business
2003
Business concepts are studied using a metamodel-based approach, using UML 2.0. The Notation Independent Business concepts metamodel is introduced. The approach offers a mapping between different business modeling notations which could be used for bridging BM tools and boosting the MDA approach.
Efficient formulation of a two-noded geometrically exact curved beam element
2021
The article extends the formulation of a 2D geometrically exact beam element proposed by Jirasek et al. (2021) to curved elastic beams. This formulation is based on equilibrium equations in their integrated form, combined with the kinematic relations and sectional equations that link the internal forces to sectional deformation variables. The resulting first-order differential equations are approximated by the finite difference scheme and the boundary value problem is converted to an initial value problem using the shooting method. The article develops the theoretical framework based on the Navier-Bernoulli hypothesis, with a possible extension to shear-flexible beams. Numerical procedures …
MODELIZACIÓN MEDIANTE CFD DE PARA EVALUAR LA VENTILACIÓN EN UN EDIFICIO ARQUEOLÓGICO, DATOS PRELIMINARES.
2016
[EN] The present study addresses the influences of wind flow structure, as an important factor responsible of material damage (erosion contributing) on “Casa di Diana” Mithraeum, a roman building (130 A.D.) sited on Ostia Antica (archaeological site, Rome – Italy), through the Computational Fluid Dynamics (CFD) simulations and direct measurements for its verification and validation (V&V). In this preliminary work, we present results relating to 3D reconstruction (geometry of the entire building) and the mesh importing on Fluent software. In general, the data check confirms, with ±10%, a good agreement (model) between the numerical solutions and direct measurements data by portable sensor. F…
Influence of drag and turbulence modelling on CFD predictions of solid liquid suspensions in stirred vessels
2014
Abstract Suspensions of solid particles into liquids within industrial stirred tanks are frequently carried out at an impeller speed lower than the minimum required for complete suspension conditions. This choice allows power savings which usually overcome the drawback of a smaller particle-liquid interfacial area. Despite this attractive economical perspective, only limited attention has been paid so far to the modelling of the partial suspension regime. In the present work two different baffled tanks stirred by Rushton turbines were simulated by employing the Eulerian-Eulerian Multi Fluid Model (MFM) along with either the Sliding Grid algorithm (transient simulations) or the Multiple Refe…
Approximation of functions over manifolds : A Moving Least-Squares approach
2021
We present an algorithm for approximating a function defined over a $d$-dimensional manifold utilizing only noisy function values at locations sampled from the manifold with noise. To produce the approximation we do not require any knowledge regarding the manifold other than its dimension $d$. We use the Manifold Moving Least-Squares approach of (Sober and Levin 2016) to reconstruct the atlas of charts and the approximation is built on-top of those charts. The resulting approximant is shown to be a function defined over a neighborhood of a manifold, approximating the originally sampled manifold. In other words, given a new point, located near the manifold, the approximation can be evaluated…
Fully Automatic Trunk Packing with Free Placements
2010
We present a new algorithm to compute the volume of a trunk according to the SAE J1100 standard. Our new algorithm uses state-of-the-art methods from computational geometry and from combinatorial optimization. It finds better solutions than previous approaches for small trunks.
Topology-based goodness-of-fit tests for sliced spatial data
2023
In materials science and many other application domains, 3D information can often only be extrapolated by taking 2D slices. In topological data analysis, persistence vineyards have emerged as a powerful tool to take into account topological features stretching over several slices. In the present paper, we illustrate how persistence vineyards can be used to design rigorous statistical hypothesis tests for 3D microstructure models based on data from 2D slices. More precisely, by establishing the asymptotic normality of suitable longitudinal and cross-sectional summary statistics, we devise goodness-of-fit tests that become asymptotically exact in large sampling windows. We illustrate the test…