Search results for " simulations"

showing 10 items of 243 documents

Free Energy, Enthalpy and Entropy from Implicit Solvent End-Point Simulations

2018

Free energy is the key quantity to describe the thermodynamics of biological systems. In this perspective we consider the calculation of free energy, enthalpy and entropy from end-point molecular dynamics simulations. Since the enthalpy may be calculated as the ensemble average over equilibrated simulation snapshots the difficulties related to free energy calculation are ultimately related to the calculation of the entropy of the system and in particular of the solvent entropy. In the last two decades implicit solvent models have been used to circumvent the problem and to take into account solvent entropy implicitly in the solvation terms. More recently outstanding advancement in both impli…

Energy estimationEnthalpyContinuum solvent Enthalpy Entropy Free energy Implicit solvent MM/GBSA Molecular dynamics simulationscontinuum solvent010402 general chemistry01 natural sciencesBiochemistry Genetics and Molecular Biology (miscellaneous)BiochemistryMolecular dynamicsenthalpy0103 physical sciencesMolecular BiosciencesStatistical physicsPhysics::Chemical PhysicsMolecular Biologylcsh:QH301-705.5PhysicsMM/GBSAQuantitative Biology::BiomoleculesEnd point010304 chemical physicsEnsemble averageSolvationimplicit solventmolecular dynamics simulationsfree energy0104 chemical sciencesSolventlcsh:Biology (General)Solvent modelsPerspectiveentropyFrontiers in Molecular Biosciences
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Implementation of walk-through audits for designing energy management system: A first step towards an efficient campus

2020

Abstract The purpose of this study is to design a concept of energy management control system (EMCS) at the UNSADA campus, Jakarta, Indonesia by utilizing the results of the previous walkthrough audit. EMCS is an important first step by involving all parties on campus to be concerned the sustainable energy savings. The energy efficiency program utilizes the campus as an energy laboratory to identify, recommend, implement and evaluate the energy consumption, so that the expected energy efficiency targeted by the top managements can be achieved. This program is motivated by several reasons, such as; to support government policies in reducing dependence on fossil energy by implementing energy …

Energy management systemEnergy conservationEngineering managementService (systems architecture)energy concerns ; energy load reduction ; energy measurement ; energy simulations ; zero energy buildingComputer scienceEnergy managementAuditEnergy consumptionSoftware walkthroughEfficient energy useIOP Conference Series: Earth and Environmental Science
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Energy measurements at Skarpnes zero energy homes in Southern Norway: Do the loads match up with the on-site energy production?

2017

Five houses are designed as zero-energy homes in Skarpnes, Norway. The energy goal is to achieve net zero-energy balance on an annual basis. The houses have heat pumps and solar cells (PV). Energy use and delivered energy have been monitored from June 2015. Variations between calculations and measurements are explained by technical and non-technical reasons. For the first year, higher than expected energy loads result in a solar energy cover factor of 65–87% of delivered electricity. The PV generation performs satisfactorily, hence, it may be possible to achieve energy goals during later years provided technical adjustments or behavioral changes. Acknowledgements. This report has been writt…

EngineeringArchitectural engineering020209 energyZero emission building; ZEB02 engineering and technologyZero energy buildings:Teknologi: 500 [VDP]Energimålinger0202 electrical engineering electronic engineering information engineeringProduction (economics)Energy measurementsZero emissionPhotovolatic systemZero-energy buildingNorwaybusiness.industry:Technology: 500 [VDP]VDP::Technology: 500Fotovoltaisk systemBuilding energy simulationsVDP::Teknologi: 500Null energibyggResearch centreResearch councilBygninger energisimuleringerElectricitybusinessZero energy homesEnergy Procedia
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Modular, customisable, accomodation-friendly antenna system for satellite avionics: Development, prototyping and validation

2014

In the frame of ESA program AO/1- 6737/11/NL/MH, an innovative X-band antenna system for satellite avionics has been studied, demonstrated and validated at Proof of Concept Model level. The innovative contribution of such an antenna system relies on modularity, customizability and accommodation friendliness. The antenna concept is based on a Plug and Play architecture, where the basic module is a 2.7 cm-cube with a mass of 53 gr, which can be clustered in array configuration. A catalogue of predefined and ready-to-use clusters could be developed with the possibility of adapting the antenna systems to various platform types by tuning just a few control parameters. Different levels of customi…

EngineeringAvionics Plug and Play architecture modularity customizability bonding wires PIFA measurements simulations.Plug and playbusiness.industryConformal antennaFrame (networking)Modular designAvionicsModularitySettore ING-INF/01 - ElettronicaSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)Proof of conceptAntenna (radio)businessSimulationAntenna satellite
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Using FEM simulation to predict structural performances of a sailing dinghy

2017

The use of finite element method (FEM) tools is proposed to investigate the structural response of an eco-sustainable sailing yacht to different loading conditions, typical of those acting during regattas. The boat is, in particular, a 4.60 m dinghy with the hull and the deck made of an hybrid flax–cork sandwich and internal reinforcements made of marine plywood. A preliminary activity has consisted in the refitting of an existing model in order to reduce the hull weight and to improve performances during manoeuvrings. These tasks have been interactively simulated in the virtual environment of the boat CAD model, where longitudinal and transversal reinforcements were enlightened and the m…

EngineeringFEMbusiness.industry020101 civil engineering02 engineering and technologyStructural engineeringFinite element methodIndustrial and Manufacturing Engineering0201 civil engineeringDeckModeling and simulation020303 mechanical engineering & transports0203 mechanical engineeringBeam (nautical)FEM; Refitting; Sailing yacht; Modeling and Simulation; Industrial and Manufacturing EngineeringRefittingHullModeling and SimulationSailing yachtEngineering design processbusinessSettore ING-IND/15 - Disegno E Metodi Dell'Ingegneria IndustrialeStrain gaugeFem simulations
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Flexible power converters for the fault tolerant operation of Micro-Grids

2010

The progressive penetration level of Distributed Generation (DG) is destined to cause deep changes in the existing distribution networks no longer considered as passive terminations of the whole electrical system. A possible solution is the realization of small networks, namely the Micro-Grids, reproducing in themselves the structure of the main production and distribution of the electrical energy system. In order to gain an adequate reliability level of the microgrids the individuation and the management of the faults with the goal of maintaining the micro-grid operation (fault tolerant operation) is quite important. In the present paper flexible power converters and a companion control al…

Engineeringpower generation controlDistribution networksFault Tolerancepower generation reliabilityGeneratorSettore ING-IND/32 - Convertitori Macchine E Azionamenti Elettricifault tolerant power converterElectric power systemdistributed power generationpower convertorcomputer simulationElectronic engineeringConverterIndexeflexible power convertersCircuit faultLegdistributed generationFault tolerant systembusiness.industryElectric potential energyFault toleranceelectrical energy systemConvertersdistributed power generation;fault tolerance;power convertors;power generation control;power generation reliability;companion control algorithm;computer simulations;distributed generation;electrical energy system;fault tolerant power converters;flexible power converters;microgrid operation;Circuit faults;Converters;Fault tolerance;Fault tolerant systems;Generators;Indexes;Leg;Fault Tolerance;Faults;Micro-Grid;flexible power converterscompanion control algorithmFaultPower (physics)microgrid operationDistributed generationflexible power converterMicro-GridbusinessRealization (systems)The XIX International Conference on Electrical Machines - ICEM 2010
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1-D numerical simulation of sediment transport in alluvial channel beds

2011

Quantitative estimate of sediment transport processes is important especially in river-control engineering and for water management projects. In this paper the sediment routing of a 1-D model is presented and applied to some study cases. The procedure simulates the variations of bed roughness conditions due to natural sorting and to generation and migration of bed forms. The suspended-load and the bed-load are treated separatel

Environmental Engineeringsediment transport flow resistance numerical simulationsCivil and Structural Engineering
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A paradigm of extreme rainfall pluvial floods in complex urban areas: the flood event of 15 July 2020 in Palermo (Italy)

2021

Abstract. In the last years, some regions of the Mediterranean area are witnessing a progressive increase in extreme events, such as urban and flash floods, as a response to the increasingly frequent and severe extreme rainfall events and their ground effects, which are often exacerbated by ever-growing urbanization. In such a context, the traditional defense of urban areas, which are usually based on urban drainage systems designed without regard to the impacts of urbanization and climate change on natural systems, may not be sufficient to deal with the risk deriving from the occurrence of such events. This study focuses on a very recent and particularly intense urban flood that occurred i…

Extreme rainfall urban floods 2D hydraulic simulations floodability
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Measurement of the cosmic ray energy spectrum using hybrid events of the Pierre Auger Observatory

2012

The energy spectrum of ultra-high energy cosmic rays above 10$^{18}$ eV is measured using the hybrid events collected by the Pierre Auger Observatory between November 2005 and September 2010. The large exposure of the Observatory allows the measurement of the main features of the energy spectrum with high statistics. Full Monte Carlo simulations of the extensive air showers (based on the CORSIKA code) and of the hybrid detector response are adopted here as an independent cross check of the standard analysis (Phys. Lett. B 685, 239 (2010)). The dependence on mass composition and other systematic uncertainties are discussed in detail and, in the full Monte Carlo approach, a region of confiden…

FLUORESCENCE DETECTORAstronomyAstrophysics::High Energy Astrophysical PhenomenaMonte Carlo methodenergy spectrumFOS: Physical sciencesGeneral Physics and AstronomyFluxCosmic rayEXTENSIVE AIR-SHOWERSSURFACE DETECTOR01 natural sciencesCosmic RayAugerPierre Auger Observatory ; Monte Carlo simulations ; ultra-high energy cosmic raysHigh Energy Physics - ExperimentNuclear physicsHigh Energy Physics - Experiment (hep-ex)Observatory0103 physical sciencesRECONSTRUCTIONFermilab010306 general physicsUHE Cosmic Rays Monte Carlo Energy SpectrumTRIGGERNuclear PhysicsHigh Energy Astrophysical Phenomena (astro-ph.HE)PhysicsPierre Auger ObservatoryPACS: 96.50.S 96.50.sb 96.50.sd 98.70.Sa010308 nuclear & particles physics[SDU.ASTR.HE]Sciences of the Universe [physics]/Astrophysics [astro-ph]/High Energy Astrophysical Phenomena [astro-ph.HE]Pierre Auger Observatory; Monte Carlo simulations; ultra-high energy cosmic raysPhysicsDetectorAstrophysics::Instrumentation and Methods for AstrophysicsPierre Auger ObservatoryPROFILES[PHYS.PHYS.PHYS-SPACE-PH]Physics [physics]/Physics [physics]/Space Physics [physics.space-ph]Experimental High Energy PhysicsSIMULATIONComputingMethodologies_DOCUMENTANDTEXTPROCESSINGARRAYFísica nuclearAstrophysics - High Energy Astrophysical PhenomenaRAIOS CÓSMICOS
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A rule‐based method to model myocardial fiber orientation in cardiac biventricular geometries with outflow tracts

2019

Rule-based methods are often used for assigning fiber orientation to cardiac anatomical models. However, existing methods have been developed using data mostly from the left ventricle. As a consequence, fiber information obtained from rule-based methods often does not match histological data in other areas of the heart such as the right ventricle, having a negative impact in cardiac simulations beyond the left ventricle. In this work, we present a rule-based method where fiber orientation is separately modeled in each ventricle following observations from histology. This allows to create detailed fiber orientation in specific regions such as the endocardium of the right ventricle, the inter…

FOS: Computer and information sciencesmedicine.medical_specialtyHeart VentriclesBiomedical EngineeringFOS: Physical sciencesVolume mesh030204 cardiovascular system & hematology[INFO.INFO-AI]Computer Science [cs]/Artificial Intelligence [cs.AI]030218 nuclear medicine & medical imagingComputational Engineering Finance and Science (cs.CE)03 medical and health sciences0302 clinical medicineRule-based methodInternal medicine[INFO.INFO-IM]Computer Science [cs]/Medical ImagingmedicineHumansComputer SimulationElectrophysiological simulationsInterventricular septumOutflow tractComputer Science - Computational Engineering Finance and ScienceMolecular BiologyEndocardiumFiber (mathematics)Orientation (computer vision)MyocardiumApplied MathematicsFiber orientationOutflow tract ventricular arrhythmiaModels CardiovascularRule-based systemSeptumMagnetic Resonance Imaging[INFO.INFO-MO]Computer Science [cs]/Modeling and SimulationPhysics - Medical PhysicsElectrophysiological Phenomenamedicine.anatomical_structureComputational Theory and MathematicsVentricleModeling and Simulationcardiovascular systemCardiologyOutflowMedical Physics (physics.med-ph)SoftwareGeologyInternational Journal for Numerical Methods in Biomedical Engineering
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