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Computational Simulation (computational + simulation)

Distribution by Scientific Domains

Medical Sciences	36%
Engineering	26%
Polymers and Materials Science	10%
Chemistry	10%

Selected Abstracts

Computational Simulation of the Blood Separation Process

ARTIFICIAL ORGANS, Issue 8 2005
Sandro De Gruttola
Abstract:, The aim of this work is to construct a computational fluid dynamics model capable of simulating the quasitransient process of apheresis. To this end a Lagrangian,Eulerian model has been developed which tracks the blood particles within a delineated two-dimensional flow domain. Within the Eulerian method, the fluid flow conservation equations within the separator are solved. Taking the calculated values of the flow field and using a Lagrangian method, the displacement of the blood particles is calculated. Thus, the local blood density within the separator at a given time step is known. Subsequently, the flow field in the separator is recalculated. This process continues until a quasisteady behavior is reached. The simulations show good agreement with experimental results. They shows a complete separation of plasma and red blood cells, as well as nearly complete separation of red blood cells and platelets. The white blood cells build clusters in the low concentrate cell bed. [source]

Mechanistic hypotheses for nonsynaptic epileptiform activity induction and its transition from the interictal to ictal state,Computational simulation

EPILEPSIA, Issue 11 2008
Antônio-Carlos G. De Almeida
Summary Purpose:, The aim of this work is to study, by means of computational simulations, the induction and sustaining of nonsynaptic epileptiform activity. Methods:, The computational model consists of a network of cellular bodies of neurons and glial cells connected to a three-dimensional (3D) network of juxtaposed extracellular compartments. The extracellular electrodiffusion calculation was used to simulate the extracellular potential. Each cellular body was represented in terms of the transmembrane ionic transports (Na+/K+ pumps, ionic channels, and cotransport mechanisms), the intercellular electrodiffusion through gap-junctions, and the neuronal interaction by electric field and the variation of cellular volume. Results:, The computational model allows simulating the nonsynaptic epileptiform activity and the extracellular potential captured the main feature of the experimental measurements. The simulations of the concomitant ionic fluxes and concentrations can be used to propose the basic mechanisms involved in the induction and sustaining of the activities. Discussion:, The simulations suggest: The bursting induction is mediated by the Cl, Nernst potential overcoming the transmembrane potential in response to the extracellular [K+] increase. The burst onset is characterized by a critical point defined by the instant when the Na+ influx through its permeable ionic channels overcomes the Na+/K+ pump electrogenic current. The burst finalization is defined by another critical point, when the electrogenic current of the Na+/K+ pump overcomes its influx through the channels. [source]

SIMULATION OF THIN-FILM DEODORIZERS IN PALM OIL REFINING

JOURNAL OF FOOD PROCESS ENGINEERING, Issue 2010
ROBERTA CERIANI
ABSTRACT As the need for healthier fats and oils (natural vitamin and trans fat contents) and interest in biofuels are growing, many changes in the world's vegetable oil market are driving the oil industry to developing new technologies and recycling traditional ones. Computational simulation is widely used in the chemical and petrochemical industries as a tool for optimization and design of (new) processes, but that is not the case for the edible oil industry. Thin-film deodorizers are novel equipment developed for steam deacidification of vegetable oils, and no work on the simulation of this type of equipment could be found in the open literature. This paper tries to fill this gap by presenting results from the study of the effect of processing variables, such as temperature, pressure and percentage of stripping steam, in the final quality of product (deacidified palm oil) in terms of final oil acidity, the tocopherol content and neutral oil loss. The simulation results have been evaluated by using the response surface methodology. The model generated by the statistical analysis for tocopherol retention has been validated by matching its results with industrial data published in the open literature. PRACTICAL APPLICATIONS This work is a continuation of our previous works (Ceriani and Meirelles 2004a, 2006; Ceriani et al. 2008), dealing with the simulation of continuous deodorization and/or steam deacidification for a variety of vegetable oils using stage-wised columns, and analyzing both the countercurrent and the cross-flow patterns. In this work, we have studied thin-film deodorizers, which are novel equipment developed for steam deacidification of vegetable oils. Here, we highlight issues related to final oil product quality and the corresponding process variables. [source]

Software framework for distributed experimental,computational simulation of structural systems

EARTHQUAKE ENGINEERING AND STRUCTURAL DYNAMICS, Issue 3 2006
Yoshikazu Takahashi
Abstract Supported by the recent advancement of experimental test methods, numerical simulation, and high-speed communication networks, it is possible to distribute geographically the testing of structural systems using hybrid experimental,computational simulation. One of the barriers for this advanced testing is the lack of flexible software for hybrid simulation using heterogeneous experimental equipment. To address this need, an object-oriented software framework is designed, developed, implemented, and demonstrated for distributed experimental,computational simulation of structural systems. The software computes the imposed displacements for a range of test methods and co-ordinates the control of local and distributed configurations of experimental equipment. The object-oriented design of the software promotes the sharing of modules for experimental equipment, test set-ups, simulation models, and test methods. The communication model for distributed hybrid testing is similar to that used for parallel computing to solve structural simulation problems. As a demonstration, a distributed pseudodynamic test was conducted using a client,server approach, in which the server program controlled the test equipment in Japan and the client program performed the computational simulation in the United States. The distributed hybrid simulation showed that the software framework is flexible and reliable. Copyright © 2005 John Wiley & Sons, Ltd. [source]

Chemical Approach for the Study of the ,Kissing Complex' of Moloney murine leukaemia Virus

HELVETICA CHIMICA ACTA, Issue 7 2008
Sébastien Porcher
Abstract The replication of Moloney murine leukaemia virus relies on the formation of a stable homodimeric ,kissing complex' of a GACG tetraloop interacting through only two C,G base pairs flanked of 5,-adjacent unpaired adenosines A9. Previous NMR investigations of a model stem loop 1 has not permitted to reveal the origin of this interaction. Therefore, with the aim of deeper comprehension of the phenomena, the model sequence 10 was prepared where position 9 has been substituted for a nucleoside offering a wider , -stacking. In this context, the wyosine phosphoramidite building block 2 was prepared and incorporated by adapting the conditions of the automated synthesis and developing original templated enzymatic ligation. However, no ,kissing interaction' has been observed for this model sequence 10 due to steric hindrance as confirmed by computational simulation. Consequently, several other model sequences, 18, 23,26, containing modified nucleosides were prepared. Finally, the importance of the cross-loop H-bond between G8 and G11 nucleobases was revealed by preparing a 18mer RNA hairpin 27, where the guanosine G8 has been substituted for inosine. The latter, which does not possess a C3 amino function compared to guanosine, is unable to form any ,kissing complex' demonstrating the importance of this secondary interaction in the formation of the complex. [source]

Flexural Strength Evaluation of Nonconstant Thickness Ceramic Floorings by Means of the Finite-Element Method

INTERNATIONAL JOURNAL OF APPLIED CERAMIC TECHNOLOGY, Issue 2 2010
Beatriz Defez
The ceramic tile industry has become an extremely competitive sector. The entry of new Asian and South American manufacturers into the market is shifting the leadership in production and exports from the traditional clusters of Europe to China, Turkey, and Brazil. In this uncertain environment, enterprises should raise the quality and cut costs by means of new products and processes. Ceramic tiles lightened by carving of a deep back relief could give rise to a generation of new, efficient products. These tiles could be manufactured with fewer raw materials than the traditional ones, which may lead to saving of weight and energy. Additionally, a lighter final product improves working conditions on the shopfloor and at the building site. Nevertheless, lightened tiles are structurally different from traditional ones, and so is their mechanical behavior. Because tiles are constructive elements, it is necessary to know their response under typical loads and assure fulfillment of the valid standards. This paper aims at evaluating the flexural strength (R) of lightened ceramic floorings using solid three-dimensional modelling and the finite-element method, establishing a new formula for the application of the international standard ISO 10545 "Ceramic Tiles." In order to achieve this objective, one reference model and 48 different relief versions were designed, which underwent a simplified computational simulation of the bending test. In accordance with the Rankine criterion, the maximal stresses of each version were calculated, as much as their distribution. Next, we correlated the results defining a new parameter called "normalized thickness," defined as the thickness that a carved tile should have to behave as a traditional flooring under flexion. This parameter allowed the adjustment of the international standard ISO 10545 to this kind of a product, facilitating their certification and therefore their real introduction in the market. Finally, thanks to the collaboration of the company Keros Cerámica S. A., it was verified that the methodology used was appropriate. [source]

CAT4 (Cable Actuated Truss,4 Degrees of Freedom): A Novel 4 DOF Cable Actuated Parallel Manipulator

JOURNAL OF FIELD ROBOTICS (FORMERLY JOURNAL OF ROBOTIC SYSTEMS), Issue 12 2002
Craig Kossowski
The CAT4 (Cable Actuated Truss,4 degrees of freedom) robot is a novel, passively jointed, parallel robot utilizing six control cables for actuation. The architecture has been under development at the Queen's University Robotics Laboratory. The robot utilizes a passive jointed linkage with 18 revolute joints to constrain the end effector motion and provide the desired structural stability, restricting the end effector to 3 translational degrees of freedom (DOF) and 1 DOF for end effector pitch. This central mechanism together with winched cable actuation gives a number of important benefits for applications where the advantages of a parallel robot are required in conjunction with light weight. Six electric motor driven winches control the length of the cable actuators that extend from the top frame to points on the end effector raft and jointed linkage to create a stiff, but lightweight, actuated robot. Simulation work on the robot is presented giving the kinematics, including a computational estimate of the workspace for a specific configuration. Results of computational simulation of the motion of the manipulator and a discussion of the advantages and potential difficulties are also presented. © 2002 Wiley Periodicals, Inc. [source]

Sensitivity of knee replacement contact calculations to kinematic measurement errors

JOURNAL OF ORTHOPAEDIC RESEARCH, Issue 9 2008
Benjamin J. Fregly
Abstract The ability to measure in vivo knee kinematics accurately makes it tempting to calculate in vivo contact forces, pressures, and areas directly from kinematic data. However, the sensitivity of contact calculations to kinematic measurement errors has not been adequately investigated. To address this issue, we developed a series of sensitivity analyses derived from a validated in vivo computational simulation of gait. The simulation used an elastic foundation contact model to reproduce in vivo contact force, center of pressure, and fluoroscopic motion data collected from an instrumented knee replacement. Treating each degree of freedom (DOF) in the simulation as motion controlled, we first quantified how errors in measured relative pose of the implant components affected contact calculations. Pose variations of ±0.1 mm or degree over the entire gait cycle changed maximum contact force, pressure, and area by 204, 100, and 117%, respectively. Larger variations of ±0.5 mm or degree changed these same quantities by 1157, 108, and 578%, respectively. In both cases, the largest sensitivities were to errors in superior-inferior translation and varus-valgus rotation, with loss of contact occurring on one or both sides. We then quantified how switching the sensitive DOFs from motion to load control affected the sensitivity results. Pose variations of ±0.5 mm or degree in the remaining DOFs changed maximum contact quantities by at most 3%. These results suggest that accuracy on the order of microns and milliradians is needed to estimate contact forces, pressures, and areas directly from in vivo kinematic measurements, and that use of load rather than motion control for the sensitive DOFs may improve the accuracy of in vivo contact calculations. © 2008 Orthopaedic Research Society. Published by Wiley Periodicals, Inc. J Orthop Res 26:1173,1179, 2008 [source]

Predictive mechanical performance evaluation of consumer food cans using stereolithography models

PACKAGING TECHNOLOGY AND SCIENCE, Issue 1 2003
D. Karalekas
Abstract The development of new metal food containers can be a technologically challenging and costly process. Understanding the interplay between the major design characteristics and requirements affecting the product's final structural capability is paramount to achieving an optimum design proposition. As a result, computer-based simulation has been employed by industry to assess a container's performance under a variety of load conditions, including axial load and panelling of cans. In this paper, the feasibility of a new approach for addressing the effects of design parameters on the structural performance of containers under development is investigated. The evaluation methodology is based on structural testing of stereolithography-built physical prototypes of a rigid metal container used for coffee packaging. It is shown that the experimentally obtained findings are in accordance to those resulting from computational simulation. This method can be used to support the development of existing and new metal containers. Copyright ©2003 John Wiley & Sons, Ltd. [source]

Pre-oxygenation and apnoea in pregnancy: changes during labour and with obstetric morbidity in a computational simulation

ANAESTHESIA, Issue 4 2009
S. H. McClelland
Summary Using the Nottingham Physiology Simulator, we investigated the effects on pre-oxygenation and apnoea during rapid sequence induction of labour, obesity, sepsis, pre-eclampsia, maternal haemorrhage and multiple pregnancy in term pregnancy. Pre-oxygenation with 100% oxygen was followed by simulated rapid sequence induction when end-tidal nitrogen tension was less than 1 kPa, and apnoea. Labour, morbid obesity and sepsis accelerated pre-oxygenation and de-oxygenation during apnoea. Fastest pre-oxygenation was in labour, with 95% of the maximum change in expired oxygen tension occurring in 47 s, compared to 97 s in a standard pregnant subject. The labouring subject with a body mass index of 50 kg.m,2 demonstrated the fastest desaturation, the time taken to fall to an arterial saturation < 90% being 98 s, compared to 292 s in a standard pregnant subject. Pre-eclampsia prolonged pre-oxygenation and tolerance to apnoea. Maternal haemorrhage and multiple pregnancy had minor effects. Our results inform the risk-benefit comparison of the anaesthetic options for Caesarean section. [source]

Computational Design and In Vitro Characterization of an Integrated Maglev Pump-Oxygenator

ARTIFICIAL ORGANS, Issue 10 2009
Juntao Zhang
Abstract For the need for respiratory support for patients with acute or chronic lung diseases to be addressed, a novel integrated maglev pump-oxygenator (IMPO) is being developed as a respiratory assist device. IMPO was conceptualized to combine a magnetically levitated pump/rotor with uniquely configured hollow fiber membranes to create an assembly-free, ultracompact system. IMPO is a self-contained blood pump and oxygenator assembly to enable rapid deployment for patients requiring respiratory support or circulatory support. In this study, computational fluid dynamics (CFD) and computer-aided design were conducted to design and optimize the hemodynamics, gas transfer, and hemocompatibility performances of this novel device. In parallel, in vitro experiments including hydrodynamic, gas transfer, and hemolysis measurements were conducted to evaluate the performance of IMPO. Computational results from CFD analysis were compared with experimental data collected from in vitro evaluation of the IMPO. The CFD simulation demonstrated a well-behaved and streamlined flow field in the main components of this device. The results of hydrodynamic performance, oxygen transfer, and hemolysis predicted by computational simulation, along with the in vitro experimental data, indicate that this pump-lung device can provide the total respiratory need of an adult with lung failure, with a low hemolysis rate at the targeted operating condition. These detailed CFD designs and analyses can provide valuable guidance for further optimization of this IMPO for long-term use. [source]

Simulating the Dynamics of Spouted-Bed Nuclear Fuel Coaters,

CHEMICAL VAPOR DEPOSITION, Issue 9 2007
S. Pannala
Abstract We describe simulation studies of the dynamics of spouted beds used for CVD coating of nuclear fuel particles. Our principal modeling tool is the Multiphase Flow with Interphase eXchanges (MFIX) code that was originally developed by the National Energy Technology Laboratory (NETL) for fossil energy process applications. In addition to standard MFIX features that allow coupling of transient hydrodynamics, heat and mass transfer, and chemical kinetics, we employ special post-processing tools to track particle mixing and circulation as functions of operating conditions and bed design. We describe in detail one major feature of the dynamics, which is the occurrence of very regular spontaneous pulsations of gas and particle flow in the spout. These pulsations appear to be critically linked to the entrainment and circulation of solids, and they produce readily accessible dynamic pressure variations that can be used for direct comparisons of model predictions with experiments. Spouted-bed dynamics are important from a CVD perspective because they directly determine the magnitude and variability of the concentration and species gradients in the zone where reactant gases first come into contact with hot particles. As this unsteady spouted-bed environment differs from other types of CVD reactors, the design and scale-up of such reactors is likely to involve unique modeling issues. Our primary goal here is to lay the groundwork for how computational simulation can be used to address these modeling issues in the specific context of nuclear fuel particle coating. [source]

The Effects of Feature-Label-Order and Their Implications for Symbolic Learning

COGNITIVE SCIENCE - A MULTIDISCIPLINARY JOURNAL, Issue 6 2010
Michael Ramscar
Abstract Symbols enable people to organize and communicate about the world. However, the ways in which symbolic knowledge is learned and then represented in the mind are poorly understood. We present a formal analysis of symbolic learning,in particular, word learning,in terms of prediction and cue competition, and we consider two possible ways in which symbols might be learned: by learning to predict a label from the features of objects and events in the world, and by learning to predict features from a label. This analysis predicts significant differences in symbolic learning depending on the sequencing of objects and labels. We report a computational simulation and two human experiments that confirm these differences, revealing the existence of Feature-Label-Ordering effects in learning. Discrimination learning is facilitated when objects predict labels, but not when labels predict objects. Our results and analysis suggest that the semantic categories people use to understand and communicate about the world can only be learned if labels are predicted from objects. We discuss the implications of this for our understanding of the nature of language and symbolic thought, and in particular, for theories of reference. [source]

Three-dimensional study of the pressure field and advantages of hemispherical crucible in silicon Czochralski crystal growth

CRYSTAL RESEARCH AND TECHNOLOGY, Issue 6 2010
F. Mokhtari
Abstract The effects of several growth parameters in cylindrical and spherical Czochralski crystal process are studied numerically and particularly, we focus on the influence of the pressure field. We present a set of three-dimensional computational simulations using the finite volume package Fluent in two different geometries, a new geometry as cylindro-spherical and the traditional configuration as cylindro-cylindrical. We found that the evolution of pressure which is has not been studied before; this important function is strongly related to the vorticity in the bulk flow, the free surface and the growth interface. It seems that the pressure is more sensitive to the breaking of symmetry than the other properties that characterize the crystal growth as temperature or velocity fields. (© 2010 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim) [source]

Mechanistic hypotheses for nonsynaptic epileptiform activity induction and its transition from the interictal to ictal state,Computational simulation

Fuzzy torque distribution control for a parallel hybrid vehicle

EXPERT SYSTEMS, Issue 1 2002
Jong-Seob Won
A fuzzy torque distribution controller for energy management (and emission control) of a parallel hybrid electric vehicle is proposed. The proposed controller is implemented in terms of a hierarchical architecture which incorporates the mode of operation of the vehicle as well as empirical knowledge of energy flow in each mode. Moreover, the rule set for each mode of operation of the vehicle is designed in view of an overall energy management strategy that ranges from maximal emphasis on battery charge sustenance to complete reliance on the electrical power source. The proposed control system is evaluated via computational simulations under the FTP75 urban drive cycle. Simulation results reveal that the proposed fuzzy torque distribution strategy is effective over the entire operating range of the vehicle in terms of performance, fuel economy and emissions. [source]

Micromechanical aspects of the shear strength of wet granular soils

INTERNATIONAL JOURNAL FOR NUMERICAL AND ANALYTICAL METHODS IN GEOMECHANICS, Issue 14 2008
U. El Shamy
Abstract This paper presents a micromechanical model for the analysis of wet granular soils at low saturation (below 30%). The discrete element method is employed to model the solid particles. The capillary water is assumed to be in a pendular state and thus exists in the form of liquid bridges at the particle-to-particle contacts. The resulting inter-particle adhesion is accounted for using the toroidal approximation of the bridge. Hydraulic hysteresis is accounted for based on the possible mechanism of the formation and breakage of the liquid bridges during wetting and drying phases. Shear test computational simulations were conducted at different water contents under relatively low net normal stresses. The results of these simulations suggest that capillary-induced attractive forces and hydraulic hysteresis play an important role in affecting the shear strength of the soil. These attractive forces produce a tensile stress that contributes to the apparent cohesion of the soil and increases its stiffness. During a drying phase, capillary-induced tensile stresses, and hence shear strength, tend to be larger than those during a wetting phase. The proposed model appears to capture the macroscopic response of wet granular materials and revealed a number of salient micromechanical mechanisms and response patterns consistent with theoretical considerations. Copyright © 2008 John Wiley & Sons, Ltd. [source]

Systems Biology of Vascular Endothelial Growth Factors

MICROCIRCULATION, Issue 8 2008
FEILIM MAC GABHANN
ABSTRACT Several cytokine families have roles in the development, maintenance, and remodeling of the microcirculation. Of these, the vascular endothelial growth factor (VEGF) family is one of the best studied and one of the most complex. Five VEGF ligand genes and five cell-surface receptor genes are known in the human, and each of these may be transcribed as multiple splice isoforms to generate an extensive family of proteins, many of which are subject to further proteolytic processing. Using the VEGF family as an example, we describe the current knowledge of growth-factor expression, processing, and transport in vivo. Experimental studies and computational simulations are being used to measure and predict the activity of these molecules, and we describe avenues of research that seek to fill the remaining gaps in our understanding of VEGF family behavior. [source]

Numerical and Experimental Analysis of an Axial Flow Left Ventricular Assist Device: The Influence of the Diffuser on Overall Pump Performance

ARTIFICIAL ORGANS, Issue 7 2005
Alexandrina Untaroiu
Abstract:, Thousands of adult cardiac failure patients may benefit from the availability of an effective, long-term ventricular assist device (VAD). We have developed a fully implantable, axial flow VAD (LEV-VAD) with a magnetically levitated impeller as a viable option for these patients. This pump's streamlined and unobstructed blood flow path provides its unique design and facilitates continuous washing of all surfaces contacting blood. One internal fluid contacting region, the diffuser, is extremely important to the pump's ability to produce adequate pressure but is challenging to manufacture, depending on the complex blade geometries. This study examines the influence of the diffuser on the overall LEV-VAD performance. A combination of theoretical analyses, computational fluid (CFD) simulations, and experimental testing was performed for three different diffuser models: six-bladed, three-bladed, and no-blade configuration. The diffuser configurations were computationally and experimentally investigated for flow rates of 2,10 L/min at rotational speeds of 5000,8000 rpm. For these operating conditions, CFD simulations predicted the LEV-VAD to deliver physiologic pressures with hydraulic efficiencies of 15,32%. These numerical performance results generally agreed within 10% of the experimental measurements over the entire range of rotational speeds tested. Maximum scalar stress levels were estimated to be 450 Pa for 6 L/min at 8000 rpm along the blade tip surface of the impeller. Streakline analysis demonstrated maximum fluid residence times of 200 ms with a majority of particles exiting the pump in 80 ms. Axial fluid forces remained well within counter force generation capabilities of the magnetic suspension design. The no-bladed configuration generated an unacceptable hydraulic performance. The six-diffuser-blade model produced a flow rate of 6 L/min against 100 mm Hg for 6000 rpm rotational speed, while the three-diffuser-blade model produced the same flow rate and pressure rise for a rotational speed of 6500 rpm. The three-bladed diffuser configuration was selected over the six-bladed, requiring only an incremental adjustment in revolution per minute to compensate for and ease manufacturing constraints. The acceptable results of the computational simulations and experimental testing encourage final prototype manufacturing for acute and chronic animal studies. [source]