• 제목/요약/키워드: Computational approach

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자유수면 포착기법과 난류모형을 이용한 급변류 수치모델링 (Numerical modeling of rapidly varied flow using the SST turbulence model and a hybrid free-surface capturing approach)

  • 김병주;백중철
    • 한국수자원학회:학술대회논문집
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    • 한국수자원학회 2020년도 학술발표회
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    • pp.149-149
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    • 2020
  • 하천에서 물 흐름이 보와 댐과 같은 수공구조물을 지날 때 일반적으로 흐름상태에 다양하고 급진적인 변화가 발생한다. 특히 흐름이 구조물을 지나면서 사류(supercritical flow)로 변하고 다시 상류(subcritical flow)로 복원되면서 일어나는 도수(hydraulic jump) 현상은 수위의 급변화, 흐름 에너지 소산, 변동성이 강한 압력 분포 등이 특징이다. 이러한 흐름 특성들은 보나 여수로와 같은 수공구조물 자체의 성능뿐만 아니라 이들 수공구조물의 하류에서 발생하는 국부세굴로 인해 구조물의 안정성에 부정적인 영향을 줄 수 있다. 따라서 수공구조물을 설계할 때는 이들 구조물을 통과하는 흐름의 비정상 난류 흐름 특성을 정확하게 해석하여 반영하여야 한다. 이 연구에서는 k-omega SST 난류 모형과 자유수면의 급격한 변동을 해석하기 위한 하이브리드-VOF(hybrid volume of fluid)기법을 이용하여 도수현상을 수치적으로 재현하고자 한다. 기존 CFD(computational fluid Dynamics) 모델링에서는 자유수면 변동의 영향을 고려하기 위해 VOF 기법을 많이 사용하였다. 하지면 전통적인 VOF 기법은 다상흐름(multiphase flow)을 오직 부피분율(volume fraction)의 함수로만 고려하며 모의함으로써 강한 수면변동뿐만 아니라 공기연행(air entrainment)를 동반하는 난류 흐름을 모의하는데는 한계가 있다. 이 연구에서 이용하는 Eulerian 기법인 하이브리드 VOF 기법은 물과 공기의 각 상에 대하여 흐름 특성들을 개별적으로 계산하기 때문에 공기연행을 포함한 급변류 흐름에서 전통적인 VOF 기법보다 적용성이 우수하다. 이와 같은 난류모형과 자유수면 포착기법을 이용하여 3차원 비정상 난류 흐름 수치모형을 구축하여 수공구조물 주변에서 발생하는 강한 공기연행과 난류 특성를 보이는 급변류를 수치적으로 재현한다. 이 연구는 계산된 수치해석 결과를 기존 수리실험 결과와 비교하여 수치모형의 적용성을 평가하고 도수 현상에서 발생하는 독특한 흐름 특성을 제시한다.

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A network pharmacology and molecular docking approach in the exploratory investigation of the biological mechanisms of lagundi (Vitex negundo L.) compounds against COVID-19

  • Robertson G. Rivera;Patrick Junard S. Regidor;Edwin C. Ruamero Jr;Eric John V. Allanigue;Melanie V. Salinas
    • Genomics & Informatics
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    • 제21권1호
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    • pp.4.1-4.18
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    • 2023
  • Coronavirus disease 2019 (COVID-19) is an inflammatory and infectious disease caused by severe acute respiratory syndrome coronavirus 2 virus with a complex pathophysiology. While COVID-19 vaccines and boosters are available, treatment of the disease is primarily supportive and symptomatic. Several research have suggested the potential of herbal medicines as an adjunctive treatment for the disease. A popular herbal medicine approved in the Philippines for the treatment of acute respiratory disease is Vitex negundo L. In fact, the Department of Science and Technology of the Philippines has funded a clinical trial to establish its potential as an adjunctive treatment for COVID-19. Here, we utilized network pharmacology and molecular docking in determining pivotal targets of Vitex negundo compounds against COVID-19. The results showed that significant targets of Vitex negundo compounds in COVID-19 are CSB, SERPINE1, and PLG which code for cathepsin B, plasminogen activator inhibitor-1, and plasminogen, respectively. Molecular docking revealed that α-terpinyl acetate and geranyl acetate have good binding affinity in cathepsin B; 6,7,4-trimethoxyflavanone, 5,6,7,8,3',4',5'-heptamethoxyflavone, artemetin, demethylnobiletin, gardenin A, geranyl acetate in plasminogen; and 7,8,4-trimethoxyflavanone in plasminogen activator inhibitor-1. While the results are promising, these are bound to the limitations of computational methods and further experimentation are needed to completely establish the molecular mechanisms of Vitex negundo against COVID-19.

Cinnamic acid derivatives as potential matrix metalloproteinase-9 inhibitors: molecular docking and dynamics simulations

  • Mohammad Hossein Malekipour;Farzaneh Shirani;Shadi Moradi;Amir Taherkhani
    • Genomics & Informatics
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    • 제21권1호
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    • pp.9.1-9.13
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    • 2023
  • Matrix metalloproteinase-9 (MMP-9) is a zinc and calcium-dependent proteolytic enzyme involved in extracellular matrix degradation. Overexpression of MMP-9 has been confirmed in several disorders, including cancers, Alzheimer's disease, autoimmune diseases, cardiovascular diseases, and dental caries. Therefore, MMP-9 inhibition is recommended as a therapeutic strategy for combating various diseases. Cinnamic acid derivatives have shown therapeutic effects in different cancers, Alzheimer's disease, cardiovascular diseases, and dental caries. A computational drug discovery approach was performed to evaluate the binding affinity of selected cinnamic acid derivatives to the MMP-9 active site. The stability of docked poses for top-ranked compounds was also examined. Twelve herbal cinnamic acid derivatives were tested for possible MMP-9 inhibition using the AutoDock 4.0 tool. The stability of the docked poses for the most potent MMP-9 inhibitors was assessed by molecular dynamics (MD) in 10 nanosecond simulations. Interactions between the best MMP-9 inhibitors in this study and residues incorporated in the MMP-9 active site were studied before and after MD simulations. Cynarin, chlorogenic acid, and rosmarinic acid revealed a considerable binding affinity to the MMP-9 catalytic domain (ΔGbinding < -10 kcal/ mol). The inhibition constant value for cynarin and chlorogenic acid were calculated at the picomolar scale and assigned as the most potent MMP-9 inhibitor from the cinnamic acid derivatives. The root-mean-square deviations for cynarin and chlorogenic acid were below 2 Å in the 10 ns simulation. Cynarin, chlorogenic acid, and rosmarinic acid might be considered drug candidates for MMP-9 inhibition.

Using Bayesian tree-based model integrated with genetic algorithm for streamflow forecasting in an urban basin

  • Nguyen, Duc Hai;Bae, Deg-Hyo
    • 한국수자원학회:학술대회논문집
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    • 한국수자원학회 2021년도 학술발표회
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    • pp.140-140
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    • 2021
  • Urban flood management is a crucial and challenging task, particularly in developed cities. Therefore, accurate prediction of urban flooding under heavy precipitation is critically important to address such a challenge. In recent years, machine learning techniques have received considerable attention for their strong learning ability and suitability for modeling complex and nonlinear hydrological processes. Moreover, a survey of the published literature finds that hybrid computational intelligent methods using nature-inspired algorithms have been increasingly employed to predict or simulate the streamflow with high reliability. The present study is aimed to propose a novel approach, an ensemble tree, Bayesian Additive Regression Trees (BART) model incorporating a nature-inspired algorithm to predict hourly multi-step ahead streamflow. For this reason, a hybrid intelligent model was developed, namely GA-BART, containing BART model integrating with Genetic algorithm (GA). The Jungrang urban basin located in Seoul, South Korea, was selected as a case study for the purpose. A database was established based on 39 heavy rainfall events during 2003 and 2020 that collected from the rain gauges and monitoring stations system in the basin. For the goal of this study, the different step ahead models will be developed based in the methods, including 1-hour, 2-hour, 3-hour, 4-hour, 5-hour, and 6-hour step ahead streamflow predictions. In addition, the comparison of the hybrid BART model with a baseline model such as super vector regression models is examined in this study. It is expected that the hybrid BART model has a robust performance and can be an optional choice in streamflow forecasting for urban basins.

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ANN 및 SVM을 사용하여 투과 유량을 예측하는 동적 막 여과 공정 모델링 (Modeling of a Dynamic Membrane Filtration Process Using ANN and SVM to Predict the Permeate Flux)

  • 수피안 라데그;모하메드 무사우이;마마르 라이디;나지 물라이-모스테파
    • 멤브레인
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    • 제33권1호
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    • pp.34-45
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    • 2023
  • 본 연구에서는 투과 유량 모델을 개발하기 위하여, 시간, 막 전후의 압력 차, 회전 속도, 막의 기공 크기, 동점도, 농도 및 공급 유체의 밀도 등 7개의 입력 변수에 기반한 두 종류(ANN 및 SVM) 인공지능 기법을 이용하였다. 시행착오법과 실험데이터와 예측 데이터 간의 결정 계수(R2) 와 평균절대상대편차(AARD)를 포함한 두 가지 통계 변수를 통해 최적의 모델을 선정하였다. 최종적으로 얻어진 결과에서 최적화된 ANN 모델이 R2 = 0.999 및 AARD% = 2.245인 투과 플럭스 예측 정확도를 보여서, R2 = 0.996 및 AARD% = 4.09의 정확도를 보인 SVM 모델에 비해 더 정확함을 알 수 있었다. 또한, ANN 모델은 SVM 방식에 비해 투과 유속을 예측하는 능력도 더 높은 것으로 나타났다.

A new multi-stage SPSO algorithm for vibration-based structural damage detection

  • Sanjideh, Bahador Adel;Hamzehkolaei, Azadeh Ghadimi;Hosseinzadeh, Ali Zare;Amiri, Gholamreza Ghodrati
    • Structural Engineering and Mechanics
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    • 제84권4호
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    • pp.489-502
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    • 2022
  • This paper is aimed at developing an optimization-based Finite Element model updating approach for structural damage identification and quantification. A modal flexibility-based error function is introduced, which uses modal assurance criterion to formulate the updating problem as an optimization problem. Because of the inexplicit input/output relationship between the candidate solutions and the error function's output, a robust and efficient optimization algorithm should be employed to evaluate the solution domain and find the global extremum with high speed and accuracy. This paper proposes a new multi-stage Selective Particle Swarm Optimization (SPSO) algorithm to solve the optimization problem. The proposed multi-stage strategy not only fixes the premature convergence of the original Particle Swarm Optimization (PSO) algorithm, but also increases the speed of the search stage and reduces the corresponding computational costs, without changing or adding extra terms to the algorithm's formulation. Solving the introduced objective function with the proposed multi-stage SPSO leads to a smart feedback-wise and self-adjusting damage detection method, which can effectively assess the health of the structural systems. The performance and precision of the proposed method are verified and benchmarked against the original PSO and some of its most popular variants, including SPSO, DPSO, APSO, and MSPSO. For this purpose, two numerical examples of complex civil engineering structures under different damage patterns are studied. Comparative studies are also carried out to evaluate the performance of the proposed method in the presence of measurement errors. Moreover, the robustness and accuracy of the method are validated by assessing the health of a six-story shear-type building structure tested on a shake table. The obtained results introduced the proposed method as an effective and robust damage detection method even if the first few vibration modes are utilized to form the objective function.

능동소음제어 기술을 이용한 층간소음 저감효과 분석 (Analysis of Reduction Effect of Inter-Floor Noise Using Active Noise Control (ANC) Technique)

  • 김호진;김중관;김준환;김현석;위혁
    • 한국방재안전학회논문집
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    • 제16권3호
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    • pp.45-56
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    • 2023
  • 본 연구에서는 능동소음제어(ANC) 기술을 층간소음 분야에 적용하기 위하여 40~500 Hz 대역의 중량충격음을 제어하기 위한 ANC 시스템을 구성하였다. ANC 시스템에는 Fx-LMS 알고리즘 기반의 적응형 필터를 활용한 피드포워드 방식의 제어기술을 도입하였다. ANC 시스템 설정을 위해 가상 시뮬레이션을 통해 ANC를 구성하는 변수 연구를 실시하였고, 이를 통해 최적 필터와 시스템 배치 방법을 정립하였다. 또한 본 연구에는 개발된 ANC 시스템을 한국건설생활시험연구원(KCL)의 층간소음 시험실에 설치한 후 표준시험방법에 따라 ANC 시스템 구동 전후 4 dB의 층간소음 저감효과를 확인하였다. 시험결과를 통해 본 연구에서 개발한 ANC 시스템이 중량충격음에 대한 등급 기준을 한 단계를 상향시킬 수 있는 수준의 효과가 있음을 확인하였다.

An Investigation of Interfacial Strength in Epoxy-based Solid Polymer Electrolytes for Structural Composite Batteries

  • Mohamad A. Raja;Su Hyun Lim;Doyun Jeon;Hyunsoo Hong;Inyeong Yang;Sanha Kim;Seong Su Kim
    • Composites Research
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    • 제36권6호
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    • pp.416-421
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    • 2023
  • Multifunctional composite materials capable of both load-carrying and energy functions are promising innovative candidates for the advancement of contemporary technologies owing to their relative feasibility, cost-effectiveness, and optimized performance. Carbon fiber (CF)-based structural batteries utilize the graphitic inherent structure to enable the employment of carbon fibers as electrodes, current collectors, and reinforcement, while the matrix system is an ion-conduction and load transfer medium. Although it is possible to enhance performance through the modification of constituents, there remains a need for a systematic design methodology scheme to streamline the commercialization of structural batteries. In this work, a bi-phasic epoxy-based ionic liquid (IL) modified structural battery electrolyte (SBE) was developed via thermally initiated phase separation. The polymer's morphological, mechanical, and electrochemical characteristics were studied. In addition, the interfacial shear strength (IFSS) between CF/SBE was investigated via microdroplet tests. The results accentuated the significance of considering IFSS and matrix plasticity in designing composite structural batteries. This approach is expected to lay the foundation for realizing smart structures with optimized performance while minimizing the need for extensive trial and error, by paving the way for a streamlined computational design scheme in the future.

시각적 문해력을 활용한 프로그래밍 교육의 효과 : 예술계열 중심으로 (Effects of Programming Education using Visual Literacy: Focus on Arts Major)

  • 피수영;손현숙
    • 실천공학교육논문지
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    • 제16권2호
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    • pp.105-114
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    • 2024
  • 최근 소프트웨어 역량이 강조됨에 따라 대학에서는 전공 구분없이 모든 학생들에게 소프트웨어 교육을 진행하고 있다. 비전공자들은 소프트웨어 교육에 대한 동기부여가 부족하고, 생소한 학습 콘텐츠에 대한 체감 난이도가 높은 문제가 있다. 이를 해결하기 위해 학습자 특성에 맞는 소프트웨어 교육을 제공해야 한다. 예술계열 학생들은 시각에 대한 이해와 표현력이 뛰어나므로 시각적 문해력을 활용하면 프로그래밍 교육의 학습효과를 높일 수 있다고 본다. 본 연구에서는 일상의 문제를 순서도와 의사코드로 분해하여 절차적으로 시각적 이미지를 구성한다. 이를 교육용 프로그래밍 언어인 플레이봇을 이용하여 코딩을 하고 문제를 해결하도록 진행하여 수업의 효과를 분석하고자 한다. 이를 통해 학생들은 프로그래밍의 개념을 이해하고, 문제를 컴퓨팅적 사고로 해결하는 과정을 이해할 수 있으며, 프로그래밍을 자신의 전공에 활용하는 방법을 습득할 수 있을 것으로 기대한다.

Exploring Efficient Solutions for the 0/1 Knapsack Problem

  • Dalal M. Althawadi;Sara Aldossary;Aryam Alnemari;Malak Alghamdi;Fatema Alqahtani;Atta-ur Rahman;Aghiad Bakry;Sghaier Chabani
    • International Journal of Computer Science & Network Security
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    • 제24권2호
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    • pp.15-24
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    • 2024
  • One of the most significant issues in combinatorial optimization is the classical NP-complete conundrum known as the 0/1 Knapsack Problem. This study delves deeply into the investigation of practical solutions, emphasizing two classic algorithmic paradigms, brute force, and dynamic programming, along with the metaheuristic and nature-inspired family algorithm known as the Genetic Algorithm (GA). The research begins with a thorough analysis of the dynamic programming technique, utilizing its ability to handle overlapping subproblems and an ideal substructure. We evaluate the benefits of dynamic programming in the context of the 0/1 Knapsack Problem by carefully dissecting its nuances in contrast to GA. Simultaneously, the study examines the brute force algorithm, a simple yet comprehensive method compared to Branch & Bound. This strategy entails investigating every potential combination, offering a starting point for comparison with more advanced techniques. The paper explores the computational complexity of the brute force approach, highlighting its limitations and usefulness in resolving the 0/1 Knapsack Problem in contrast to the set above of algorithms.