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In-silico Identification of Novel Drug Target for Osteoarthritis using Network Biology Approaches 应用网络生物学方法对骨关节炎新药物靶点的计算机识别
Q3 Computer Science Pub Date : 2022-06-23 DOI: 10.2174/18750362-v15-e220623-2021-14
Nityendra Shukla, N. Srivastava, Aditya Trivedi, P. Seth, P. Srivastava
Osteoarthritis (OA) is a degenerative joint disease which is the leading cause for physical disability among the adult population and yet the mechanisms responsible for the development and progression are not well understood. Since it has no curative solutions, treatment is limited to symptomatic targeting and improving quality of life. There is a lack of disease-modifying therapeutics and non-surgical intervention options to prevent the progression of disease. Risk factors range from systemic (e.g. age, sex, genetics, obesity) to biochemical (e.g. joint injury, muscle weakness, sport). The prevalence of OA is ever increasing due to the ageing global population and the obesity epidemic. Since OA exhibits strong genetic predisposition and a complex pathogenesis, we applied an in silico network biology approaches to identify a candidate gene using a protein-protein interaction (PPI) network of OA, which may be an important aspect of disease pathogenesis and assist us in furthering our understanding of the development and progression of the disease as well as identify a drug-lead for the treatment of joint-pain associated with OA and improving quality of life in patients without lasting side effects. Our findings suggest that phytochemical compounds may be promising candidates for multi-target application against OA and will assist in development of new molecules.
骨关节炎(OA)是一种退行性关节疾病,是成年人身体残疾的主要原因,但其发生和发展的机制尚不清楚。由于没有治愈的方法,治疗仅限于对症治疗和改善生活质量。目前缺乏改善疾病的治疗方法和非手术干预措施来预防疾病的进展。危险因素从系统(如年龄、性别、遗传、肥胖)到生化(如关节损伤、肌肉无力、运动)不等。由于全球人口老龄化和肥胖的流行,OA的患病率不断增加。由于OA表现出强烈的遗传易感性和复杂的发病机制,我们应用了硅网络生物学方法,利用OA的蛋白质-蛋白质相互作用(PPI)网络来鉴定候选基因。这可能是疾病发病机制的一个重要方面,并有助于我们进一步了解疾病的发展和进展,以及确定治疗与OA相关的关节疼痛的药物,并改善患者的生活质量,而不会产生持久的副作用。我们的研究结果表明,植物化学化合物可能是抗OA多靶点应用的有希望的候选者,并将有助于新分子的开发。
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引用次数: 0
Use of Two Complementary Bioinformatic Approaches to Identify Differentially Methylated Regions in Neonatal Sepsis 利用两种互补的生物信息学方法识别新生儿败血症中不同甲基化区域
Q3 Computer Science Pub Date : 2021-11-25 DOI: 10.2174/1875036202114010144
P. Navarrete, María José Garzón, Sheila Lorente-Pozo, Salvador Mena-Mollá, M. Vento, F. Pallardó, J. Beltrán-García, R. Osca-Verdegal, E. García-López, J. García-Giménez
Neonatal sepsis is a heterogeneous condition affecting preterm infants whose underlying mechanisms remain unknown. The analysis of changes in the DNA methylation pattern can contribute to improving the understanding of molecular pathways underlying disease pathophysiology. Methylation EPIC 850K BeadChip technology is an excellent tool for genome-wide methylation analyses and the detection of differentially methylated regions (DMRs). The aim is to identify DNA methylation traits in complex diseases, such as neonatal sepsis, using data from Methylation EPIC 850K BeadChip arrays. Two different bioinformatic methods, DMRcate (a supervised approach) and mCSEA (an unsupervised approach), were used to identify DMRs using EPIC data from leukocytes of neonatal septic patients. Here, we describe with detail the implementation of both methods as well as their applicability, briefly discussing the results obtained for neonatal sepsis. Differences in methylation levels were observed in neonatal sepsis patients. Moreover, differences were identified between the two subsets of the disease: Early-Onset neonatal Sepsis (EOS) and Late-Onset Neonatal Sepsis (LOS). This approach by using DMRcate and mCSA helped us to gain insight into the intricate mechanisms that may drive EOS and LOS development and progression in newborns.
新生儿脓毒症是一种影响早产儿的异质性疾病,其潜在机制尚不清楚。分析DNA甲基化模式的变化有助于提高对疾病病理生理学基础的分子途径的理解。EPIC 850K BeadChip技术是全基因组甲基化分析和差异甲基化区域(DMRs)检测的优秀工具。目的是利用methylation EPIC 850K BeadChip阵列的数据,鉴定复杂疾病(如新生儿败血症)中的DNA甲基化特征。两种不同的生物信息学方法,DMRcate(一种监督方法)和mCSEA(一种无监督方法),使用新生儿败血症患者白细胞的EPIC数据来识别DMRs。在这里,我们详细描述了这两种方法的实施及其适用性,并简要讨论了新生儿败血症的结果。新生儿败血症患者的甲基化水平存在差异。此外,该疾病的两个亚群之间也存在差异:早发型新生儿脓毒症(EOS)和晚发型新生儿脓毒症(LOS)。这种方法通过使用DMRcate和mCSA帮助我们深入了解可能驱动新生儿EOS和LOS发展和进展的复杂机制。
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引用次数: 0
A Method for Assessing the Risks of Complications in Chemoradiation Treatment of Squamous Cell Carcinoma of the Head and Neck 一种评估头颈部鳞状细胞癌放化疗并发症风险的方法
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/18750362021140100138
V. Starenkiy, S. Artiukh, M. Ugryumov, V. Strilets, Serhii Chernysh, D. Chumachenko
More than 500,000 new cases of squamous cell carcinoma of the head and neck (SCCHN) are registered annually in the world. 7,036 new cases of the disease were registered in Ukraine during 2018, about 35% of patients did not live even a year from the date of diagnosis as a modern standard for the treatment of patients with inoperable locally advanced SCCHN, chemoradiation treatment in the classical dose fractionation mode with chemo modification with cisplatin is used by specialists. The objective of this study is to analyze the effectiveness of chemoradiation treatment with cisplatin and 5-fluorouracil in the treatment of patients with SCCHN using modern mathematical models. During the investigation we assessed the effectiveness of treatment in 108 patients with locally advanced SCCHN (stages III, IVa, IVb). The results of calculating the probabilities of complications were obtained using the method of multivariate classification based on the radial basis ANN. Analyzing the groups with different methods of chemo modification, we can conclude that the method of chrono-modulated radiochemotherapy with 5-fluorouracil and the chemoradiation therapy with cisplatin were almost equal in efficiency, namely 77% and 73.5%, respectively (p=0.35). Using the chemoradiation therapy with 5-fluorouracil in the treatment of patients with low somatic status and elderly patients is more expedient in contrast to the methods using cisplatin. The advantage of selection of mentioned treatment method is also confirmed by the results of calculating the average complication risks using the method of multivariate classification based on a radial-basis neural network.
全球每年登记的头颈部鳞状细胞癌(SCCHN)新病例超过50万例。2018年,乌克兰共登记了7036例新病例,约35%的患者自诊断之日起不到一年的时间,作为治疗无法手术的局部晚期SCCHN患者的现代标准,专家使用经典剂量分次模式的放化疗顺铂化疗改良。本研究的目的是利用现代数学模型分析顺铂和5-氟尿嘧啶放化疗治疗SCCHN患者的有效性。在调查期间,我们评估了108例局部晚期SCCHN (III期、IVa期、IVb期)患者的治疗效果。采用基于径向基神经网络的多元分类方法计算并发症发生概率。分析不同化疗修饰方法组,我们可以得出5-氟尿嘧啶定时调节放化疗方法与顺铂放化疗的效率几乎相等,分别为77%和73.5% (p=0.35)。低躯体状态患者和老年患者采用5-氟尿嘧啶放化疗比采用顺铂的方法更有利。采用基于径向基神经网络的多元分类方法计算平均并发症风险的结果也证实了上述治疗方法选择的优势。
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引用次数: 1
Advances in Text and Data Mining of Biological Data: Models, Methods and Applications 生物数据文本和数据挖掘的研究进展:模型、方法和应用
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/1875036202114010036
I. Izonin, S. Babichev
The development of biological systems over billions of years has made them very difficult to understand. Biologists and clinical scientists try to understand various biological processes using different tools. However, vast amounts of data for analysis, complex multi-parameter interconnections between the data of a particular set, and hidden relationships between them significantly affect its processing and analysis. The latest advances in Artificial Intelligence (AI), mainly text mining, data mining, artificial neural networks, fuzzy logic, machine learning, and others, can significantly improve the processing of such data. In particular, it creates potential opportunities for doing high-impact investigations that can solve real-world tasks in the system biology branch. The peculiarities of biological data are that it has different types, formats, structures, and huge volumes, which significantly complicates its processing and analysis. Such processing should include models, methods, and tools for efficient storage and retrieval of various types of data; an effective conversion and consolidation of the data of multiple formats; fast optimization and transfer; reliable intellectual analysis to obtain valuable information; as well as informative data visualizations for future visual analysis or better human perception. All this necessitates combining existing and developing new, faster, and precision AI technics for future information discovery and knowledge engineering from such data.
数十亿年来生物系统的发展使人们很难理解它们。生物学家和临床科学家试图使用不同的工具来理解各种生物过程。然而,用于分析的大量数据、特定集合的数据之间复杂的多参数互连以及它们之间隐藏的关系会显著影响其处理和分析。人工智能(AI)的最新进展,主要是文本挖掘、数据挖掘、人工神经网络、模糊逻辑、机器学习等,可以显著改善对此类数据的处理。特别是,它为进行高影响调查创造了潜在的机会,可以解决系统生物学分支中的现实世界任务。生物数据的特点是它有不同的类型、格式、结构和庞大的体积,这使其处理和分析变得非常复杂。此类处理应包括用于有效存储和检索各种类型数据的模型、方法和工具;有效转换和合并多种格式的数据;快速优化和转移;可靠的智力分析,以获得有价值的信息;以及用于未来视觉分析或更好的人类感知的信息性数据可视化。所有这些都需要将现有和正在开发的新的、更快的、精确的人工智能技术结合起来,以便从这些数据中进行未来的信息发现和知识工程。
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引用次数: 0
Complex Automatic Determination of Morphological Parameters for Bone Tissue in Human Paranasal Sinuses 人鼻窦骨组织形态学参数的复杂自动测定
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/18750362021140100130
A. Nechyporenko, R. Radutny, V. Alekseeva, G. Titova, V. Gargin
Application of automated analysis currently occupies a leading position in every field of science and technology. The aim of our study was to provide a complex automatic determination of morphological parameters for bone tissue in human paranasal sinuses. The study involved 50 patients aged 20 to 60, male and female without signs of inflammatory or other pathological processes in the paranasal sinuses (PNSs). Bone density in a high-contrast image of the section can be determined by fluctuations in colour intensity. Before cleaning, the image is blurred using the Gaussian function. As a result of this operation, the images become less clear and small details merge. An algorithm known as the Connie Border Detector has found widespread use. The curves denoting the contours can run vertically, horizontally or diagonally at different angles. Detection of the direction of curves passing vertically and horizontally is not complicated, and for curves of the diagonal direction, the Sobel operator is used, with the vertical direction Gy and horizontal Gx as the value of the first derivative. Selection of areas of bone tissue requires the assessment of brightness gradient along the long side of the area. For clarity, this operation was shown graphically. Within the scope of this work, we have developed a method for an automatic comprehensive assessment of the morphological structure of the PNSs walls with the measurement of bone density and thickness.
自动化分析的应用目前在科学技术的各个领域都处于领先地位。我们研究的目的是提供一种复杂的自动测定人体鼻窦骨组织形态参数的方法。这项研究涉及50名年龄在20至60岁之间的患者,包括男性和女性,他们没有鼻窦炎症或其他病理过程的迹象。截面的高对比度图像中的骨密度可以通过颜色强度的波动来确定。在清洁之前,使用高斯函数对图像进行模糊处理。由于这种操作,图像变得不那么清晰,小细节合并。一种被称为Connie边界检测器的算法已经得到了广泛的应用。表示轮廓的曲线可以垂直、水平或以不同角度对角延伸。垂直和水平通过的曲线的方向的检测并不复杂,并且对于对角线方向的曲线,使用Sobel算子,其中垂直方向Gy和水平方向Gx作为一阶导数的值。骨组织区域的选择需要评估沿着该区域长边的亮度梯度。为了清楚起见,该操作以图形方式显示。在这项工作的范围内,我们开发了一种通过测量骨密度和厚度来自动综合评估PNSs壁形态结构的方法。
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引用次数: 2
Predicting Sepsis in the Intensive Care Unit (ICU) through Vital Signs using Support Vector Machine (SVM) 基于生命体征的支持向量机(SVM)预测重症监护病房(ICU)脓毒症
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/18750362021140100108
Zeina Rayan, Marco Alfonse, Abdel-badeeh M. Salem
As sepsis is one of the life-threatening diseases, predicting sepsis with high accuracy could help save lives. Efficiency and accuracy of predicting sepsis can be enhanced through optimal feature selection. In this work, a support vector machine model is proposed to automatically predict a patient’s risk of sepsis based on physiological data collected from the ICU. The support vector machine algorithm that uses the extracted features has a great impact on sepsis prediction, which yields the accuracy of 0.73. Predicting sepsis can be accurately performed using the main vital signs and support vector machine.
由于败血症是一种危及生命的疾病,高精度预测败血症有助于挽救生命。通过优化特征选择可以提高预测败血症的效率和准确性。在这项工作中,基于从ICU收集的生理数据,提出了一种支持向量机模型来自动预测患者患败血症的风险。使用提取特征的支持向量机算法对败血症预测有很大影响,其准确率为0.73。使用主要生命体征和支持向量机可以准确预测败血症。
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引用次数: 2
Information System for Screening and Automation of Document Management in Oncological Clinics 肿瘤临床筛查信息系统及文件管理自动化
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/1875036202114010039
V. Sheketa, M. Pasieka, S. Chupakhina, N. Pasieka, Uliana Ketsyk-Zinchenko, Y. Romanyshyn, Olha Yanyshyn
Automation of business documentation workflow in medical practice substantially accelerates and improves the process and results in better service development. Efficient use of databases, data banks, and document-oriented storage (warehouses data), including dual-purpose databases, enables performing specific actions, such as adding records, introducing changes into them, performing an either ordinary or analytical search of data, as well as their efficient processing. With the focus on achieving interaction between the distributed and heterogeneous applications and the devices belonging to the independent organizations, the specialized medical client application has been developed, as a result of which the quantity and quality of information streams of data, which can be essential for effective treatment of patients with breast cancer, have increased. The application has been developed, allowing automating the management of patient records, taking into account the needs of medical staff, especially in managing patients’ appointments and creating patient’s medical records in accordance with the international standards currently in force. This work is the basis for the smoother integration of medical records and genomics data to achieve better prevention, diagnosis, prediction, and treatment of breast cancer (oncology). Since relevant standards upgrade the functioning of health care information technology and the quality and safety of patient’s care, we have accomplished the global architectural scheme of the specific medical automation system through harmonizing the medical services specified by the HL7 international.
医疗实践中业务文档工作流程的自动化大大加快和改进了流程,并带来了更好的服务开发。高效使用数据库、数据库和面向文档的存储(仓库数据),包括两用数据库,可以执行特定操作,如添加记录、对记录进行更改、对数据进行普通或分析搜索,以及对其进行高效处理。随着对实现分布式和异构应用程序与属于独立组织的设备之间的交互的关注,专门的医疗客户端应用程序得到了开发,其结果是数据的信息流的数量和质量得到了提高,这对于癌症患者的有效治疗至关重要。该应用程序已经开发出来,可以自动管理患者记录,同时考虑到医务人员的需求,特别是在管理患者预约和根据现行国际标准创建患者医疗记录方面。这项工作是更顺利整合病历和基因组学数据的基础,以实现更好的乳腺癌症(肿瘤学)预防、诊断、预测和治疗。由于相关标准提升了医疗保健信息技术的功能以及患者护理的质量和安全,我们通过协调HL7国际规定的医疗服务,完成了特定医疗自动化系统的全球架构方案。
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引用次数: 1
Development of a Genetic Method for X-ray Images Analysis based on a Neural Network Model 基于神经网络模型的x射线图像遗传分析方法的发展
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/1875036202114010051
I. Fedorchenko, A. Oliinyk, Alexander Stepanenko, Tetiana Fedoronchak, A. Kharchenko, D. Goncharenko
Modern medicine depends on technical advances in the field of medical instrumentation and the development of medical software. One of the most important tasks for doctors is determination of the exact boundaries of tumors and other abnormal formations in the tissues of the human body. The paper considers the problems and methods of machine classification and recognition of radiographic images, as well as the improvement of artificial neural networks used to increase the quality and accuracy of detection of abnormal structures on chest radiographs. A modified genetic method for the optimization of parameters of the model on the basis of a convolutional neural network was developed to solve the problem of recognition of diagnostically significant signs of pneumonia on an X-ray of the lungs. The fundamental difference between the proposed genetic method and existing analogs is in the use of a special mutation operator in the form of an additive convolution of two mutation operators, which reduces neural network training time and also identifies "oneighborhood of solutions" that is most suitable for investigation. A comparative evaluation of the effectiveness of the proposed method and known methods was given. It showed an improvement in accuracy of solving the problem of finding signs of pathology on an X-ray of the lungs. Practical use of the developed method will reduce complexity, increase reliability of search, accelerate the process of diagnosis of diseases and reduce a part of errors and repeated inspections of patients.
现代医学依赖于医疗仪器领域的技术进步和医疗软件的发展。医生最重要的任务之一是确定人体组织中肿瘤和其他异常结构的确切边界。本文研究了x线图像机器分类识别的问题和方法,以及人工神经网络的改进,以提高胸片异常结构检测的质量和准确性。提出了一种基于卷积神经网络优化模型参数的改进遗传方法,以解决肺部x射线上诊断性肺炎体征的识别问题。所提出的遗传方法与现有类似方法的根本区别在于使用了一种特殊的突变算子,以两个突变算子的加性卷积的形式,减少了神经网络的训练时间,并识别出最适合研究的“邻域解”。并对所提方法与已知方法的有效性进行了比较评价。它显示了解决在肺部x光片上发现病理迹象的问题的准确性的提高。实际应用所开发的方法将降低复杂性,提高搜索的可靠性,加快疾病诊断的进程,减少部分错误和患者的重复检查。
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引用次数: 2
Mathematical Model of the Process of Ultrasonic wave Propagation in a Relax Environment with its Given Profiles at three Time Moments 具有给定轮廓的松弛环境中超声波在三个时刻传播过程的数学模型
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/1875036202114010087
Z. Nytrebych, V. Il'kiv, O. Malanchuk
The process of ultrasound oscillations in a relaxed environment, provided that the profiles of the acoustic wave at three time moments are known, is modeled by a three-point problem for the partial differential equation of the third order in time. This equation as a partial case contains a hyperbolic equation of the third order, which is widely used in ultrasound diagnostics. The differential-symbol method is applied to study a three-point in-time problem. The advantage of this method is the possibility to obtain a solution of the problem only through operations of differentiation. We propose the formula to construct the analytic solution of the problem, which describes the process of ultrasound oscillations propagation in a relax environment. Due to this, the profile of the ultrasonic wave is known at any time and at an arbitrary point of space. The class of quasi-polynomials is distinguished as a class of uniqueness solvability of a three-point problem. Using the proposed method, it is possible to analyze the influence of the main parameters of ultrasound diagnostics problems on the propagation of acoustic oscillations in a relaxed environment. The research example of a specific three-point problem is given.
在已知声波在三个时间时刻的分布的情况下,超声波在松弛环境中的振荡过程用三阶偏微分方程的三点问题来建模。该方程作为部分情况包含一个三阶双曲方程,在超声诊断中得到了广泛的应用。应用微分符号法研究了一个三点准时问题。这种方法的优点是可以只通过微分运算就得到问题的解。我们提出了一个公式来构造问题的解析解,它描述了超声振荡在松弛环境中的传播过程。由于这一点,超声波的轮廓是已知的,在任何时间和在任意一点的空间。将拟多项式类区分为三点问题的唯一性可解类。利用所提出的方法,可以分析超声诊断问题的主要参数在宽松环境下对声振荡传播的影响。给出了一个具体的三点问题的研究实例。
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引用次数: 1
Unsupervised Clustering in Epidemiological Factor Analysis 流行病学因素分析中的无监督聚类
Q3 Computer Science Pub Date : 2021-11-19 DOI: 10.2174/1875036202114010063
S. Dolgikh
The analysis of epidemiological data at an early phase of an epidemiological situation, when the confident correlation of contributing factors to the outcome has not yet been established, may present a challenge for conventional methods of data analysis. This study aimed to develop approaches for the early analysis of epidemiological data that can be effective in the areas with less labeled data. An analysis of a combined dataset of epidemiological statistics of national and subnational jurisdictions, aligned at approximately two months after the first local exposure to COVID-19 with unsupervised machine learning methods, including principal component analysis and deep neural network dimensionality reduction, to identify the principal factors of influence was performed. The approach and methods utilized in the study allow to clearly separate milder background cases from those with the most rapid and aggressive onset of the epidemics. The findings can be used in the evaluation of possible epidemiological scenarios and as an effective modeling approach to identify possible negative epidemiological scenarios and design corrective and preventative measures to avoid the development of epidemiological situations with potentially severe impacts.
在流行病学情况的早期阶段,当影响因素与结果的可靠相关性尚未确定时,对流行病学数据的分析可能会对传统的数据分析方法提出挑战。这项研究旨在开发在标记数据较少的地区有效的流行病学数据早期分析方法。对国家和国家以下司法管辖区的流行病学统计综合数据集进行了分析,在首次本地接触新冠肺炎约两个月后,采用无监督的机器学习方法,包括主成分分析和深度神经网络降维,以确定主要影响因素。研究中使用的方法和方法可以清楚地将较轻的背景病例与疫情最迅速、最具攻击性的病例区分开来。这些发现可用于评估可能的流行病学情景,并作为一种有效的建模方法来识别可能的负面流行病学情景,设计纠正和预防措施,以避免发展具有潜在严重影响的流行病学情况。
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引用次数: 3
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Open Bioinformatics Journal
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