5,067 research outputs found

    Enhancing the effectiveness of ligand-based virtual screening using data fusion

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    Data fusion is being increasingly used to combine the outputs of different types of sensor. This paper reviews the application of the approach to ligand-based virtual screening, where the sensors to be combined are functions that score molecules in a database on their likelihood of exhibiting some required biological activity. Much of the literature to date involves the combination of multiple similarity searches, although there is also increasing interest in the combination of multiple machine learning techniques. Both approaches are reviewed here, focusing on the extent to which fusion can improve the effectiveness of searching when compared with a single screening mechanism, and on the reasons that have been suggested for the observed performance enhancement

    MEASUREMENT AND MODELING OF HUMIDITY SENSORS

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    Humidity measurement has been increasingly important in many industries and process control applications. This thesis research focus mainly on humidity sensor calibration and characterization. The humidity sensor instrumentation is briefly described. The testing infrastructure was designed for sensor data acquisition, in order to compensate the humidity sensor’s temperature coefficient, temperature chambers using Peltier elements are used to achieve easy-controllable stable temperatures. The sensor characterization falls into a multivariate interpolation problem. Neuron networks is tried for non-linear data fitting, but in the circumstance of limited training data, an innovative algorithm was developed to utilize shape preserving polynomials in multiple planes in this kind of multivariate interpolation problems

    Feasibility of using distributed chemical sensing for CO2 leakage monitoring

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    The feasibility study focused on the development of new fiber for distributed chemical sensing (DCS) that will allow direct detection of CO2 leakages in the environment. This is particularly important for monitoring well integrity for carbon capture and storage (CCS), to provide early warning for an incoming well failure and potential CO2 leaking through it. We proposed using optical spectroscopy in optical fiber for direct detection of CO2. The main approach is based on Raman interrogation within gas-filled Holey Fibers (HoFs), so that the location and concentration of the gases would be provided simultaneously via backscattering. Additionally, Infrared (IR) Absorption Spectroscopy could also be used, and the architecture would be more discrete since interleaving with standard solid core fibers and Fiber Bragg Grating (FBG) sections is required to enable reflection to the I/O controls. The possible Raman length or the IR numbers of sections would be defined based on signal to noise ratio. The optical spectroscopy methodology would overcome current roadblocks to CCS, as fiber optics will allow for CO2 (and other gases) detection in wells with direct in-situ measurements of concentration along with other important parameters such as temperature and pressure as the baseline of environment background. We were able to assess commercially available IR/Raman hollow core fiber and demonstrated detection of CO2 through them in our controlled environment setups. We have also established the ability of drilling precisely with pulsed femtoseconds (fs)-lasers side holes to enable penetration of CO2 into the hollow core fiber and reduce diffusion rates. Open joint collars were also explored having a double functionality: splicing to solid core fiber critical for field deployment and creating gas ingress locations. Both diffusion-only and pressurized fiber systems have been constructed following numerical simulations in COMSOL based semi-hybrid optical /fluido-dynamics models. FBGs have been identified, procured, and characterized but not yet integrated. Along the work we leveraged internal modeling/design, photonics/laser characterization, optical fiber fabrication, and AM lab capabilities to design, develop and test in-house components or assemblies. Our results indicate the critical potential that the HoF would have in the direct detection of CO2 downhole

    A road map for applied data sciences supporting sustainability in advanced manufacturing: the information quality dimensions

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    Abstract Data science is a multidisciplinary blend of data inference, algorithm development, and technology in order to solve analytically complex problems. Sustainability is a critical asset of a manufacturing enterprise. It enables a business to differentiate itself from competitors and to compete efficiently and effectively to the best of its ability. This paper is a review of data analytics, and how it supports advanced manufacturing with an emphasis on sustainability. The objective is to present a context for a roadmap for applied data science addressing such analytic challenges. We start with a general introduction to advanced manufacturing and trends in modern analytics tools and technology. We then list challenges of analytics supporting advanced manufacturing and sustainability aspects. The information quality (InfoQ) framework is proposed as a backbone to evaluate the analytics needed in advanced manufacturing. The eight InfoQ dimensions are: 1) Data Resolution, 2) Data Structure, 3) Data Integration, 4) Temporal Relevance, 5) Chronology of Data and Goal, 6) Generalizability, 7) Operationalization and 8) Communication. These dimensions provide a classification of advanced manufacturing analytics domains. The paper provides a roadmap for the development of applied analytic techniques supporting advanced manufacturing and sustainability. The objective is to motivate researchers, practitioners and industrialists to support such a roadmap

    Plant-Wide Diagnosis: Cause-and-Effect Analysis Using Process Connectivity and Directionality Information

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    Production plants used in modern process industry must produce products that meet stringent environmental, quality and profitability constraints. In such integrated plants, non-linearity and strong process dynamic interactions among process units complicate root-cause diagnosis of plant-wide disturbances because disturbances may propagate to units at some distance away from the primary source of the upset. Similarly, implemented advanced process control strategies, backup and recovery systems, use of recycle streams and heat integration may hamper detection and diagnostic efforts. It is important to track down the root-cause of a plant-wide disturbance because once corrective action is taken at the source, secondary propagated effects can be quickly eliminated with minimum effort and reduced down time with the resultant positive impact on process efficiency, productivity and profitability. In order to diagnose the root-cause of disturbances that manifest plant-wide, it is crucial to incorporate and utilize knowledge about the overall process topology or interrelated physical structure of the plant, such as is contained in Piping and Instrumentation Diagrams (P&IDs). Traditionally, process control engineers have intuitively referred to the physical structure of the plant by visual inspection and manual tracing of fault propagation paths within the process structures, such as the process drawings on printed P&IDs, in order to make logical conclusions based on the results from data-driven analysis. This manual approach, however, is prone to various sources of errors and can quickly become complicated in real processes. The aim of this thesis, therefore, is to establish innovative techniques for the electronic capture and manipulation of process schematic information from large plants such as refineries in order to provide an automated means of diagnosing plant-wide performance problems. This report also describes the design and implementation of a computer application program that integrates: (i) process connectivity and directionality information from intelligent P&IDs (ii) results from data-driven cause-and-effect analysis of process measurements and (iii) process know-how to aid process control engineers and plant operators gain process insight. This work explored process intelligent P&IDs, created with AVEVA® P&ID, a Computer Aided Design (CAD) tool, and exported as an ISO 15926 compliant platform and vendor independent text-based XML description of the plant. The XML output was processed by a software tool developed in Microsoft® .NET environment in this research project to computationally generate connectivity matrix that shows plant items and their connections. The connectivity matrix produced can be exported to Excel® spreadsheet application as a basis for other application and has served as precursor to other research work. The final version of the developed software tool links statistical results of cause-and-effect analysis of process data with the connectivity matrix to simplify and gain insights into the cause and effect analysis using the connectivity information. Process knowhow and understanding is incorporated to generate logical conclusions. The thesis presents a case study in an atmospheric crude heating unit as an illustrative example to drive home key concepts and also describes an industrial case study involving refinery operations. In the industrial case study, in addition to confirming the root-cause candidate, the developed software tool was set the task to determine the physical sequence of fault propagation path within the plant. This was then compared with the hypothesis about disturbance propagation sequence generated by pure data-driven method. The results show a high degree of overlap which helps to validate statistical data-driven technique and easily identify any spurious results from the data-driven multivariable analysis. This significantly increase control engineers confidence in data-driven method being used for root-cause diagnosis. The thesis concludes with a discussion of the approach and presents ideas for further development of the methods

    Prognostic-based Life Extension Methodology with Application to Power Generation Systems

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    Practicable life extension of engineering systems would be a remarkable application of prognostics. This research proposes a framework for prognostic-base life extension. This research investigates the use of prognostic data to mobilize the potential residual life. The obstacles in performing life extension include: lack of knowledge, lack of tools, lack of data, and lack of time. This research primarily considers using the acoustic emission (AE) technology for quick-response diagnostic. To be specific, an important feature of AE data was statistically modeled to provide quick, robust and intuitive diagnostic capability. The proposed model was successful to detect the out of control situation when the data of faulty bearing was applied. This research also highlights the importance of self-healing materials. One main component of the proposed life extension framework is the trend analysis module. This module analyzes the pattern of the time-ordered degradation measures. The trend analysis is helpful not only for early fault detection but also to track the improvement in the degradation rate. This research considered trend analysis methods for the prognostic parameters, degradation waveform and multivariate data. In this respect, graphical methods was found appropriate for trend detection of signal features. Hilbert Huang Transform was applied to analyze the trends in waveforms. For multivariate data, it was realized that PCA is able to indicate the trends in the data if accompanied by proper data processing. In addition, two algorithms are introduced to address non-monotonic trends. It seems, both algorithms have the potential to treat the non-monotonicity in degradation data. Although considerable research has been devoted to developing prognostics algorithms, rather less attention has been paid to post-prognostic issues such as maintenance decision making. A multi-objective optimization model is presented for a power generation unit. This model proves the ability of prognostic models to balance between power generation and life extension. In this research, the confronting objective functions were defined as maximizing profit and maximizing service life. The decision variables include the shaft speed and duration of maintenance actions. The results of the optimization models showed clearly that maximizing the service life requires lower shaft speed and longer maintenance time

    A Review in Fault Diagnosis and Health Assessment for Railway Traction Drives

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    During the last decade, due to the increasing importance of reliability and availability, railway industry is making greater use of fault diagnosis approaches for early fault detection, as well as Condition-based maintenance frameworks. Due to the influence of traction drive in the railway system availability, several research works have been focused on Fault Diagnosis for Railway traction drives. Fault diagnosis approaches have been applied to electric machines, sensors and power electronics. Furthermore, Condition-based maintenance framework seems to reduce corrective and Time-based maintenance works in Railway Systems. However, there is not any publication that summarizes all the research works carried out in Fault diagnosis and Condition-based Maintenance frameworks for Railway Traction Drives. Thus, this review presents the development of Health Assessment and Fault Diagnosis in Railway Traction Drives during the last decade
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