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Target specificity of selective bioactive compounds in blocking α-dystroglycan receptor to suppress Lassa virus infection: an in silico approach

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The Journal of Biomedical Research 2021年第6期35卷 459-473页

作者： Adittya Arefin Tanzila Ismail Ema Tamnia Islam MdSaddam Hossen Tariqul Islam Salauddin Al Azad MdNasir Uddin Badal MdAminul Islam Partha Biswas Nafee Ul Alam Enayetul Islam Maliha Anjum Afsana Masud MdShaikh Kamran Ahsab Rahman parag kumar paul Wolfson Institute for Biomedical Research Division of MedicineUniversity College LondonLondon WC1E6AEUK Department of Biochemistry and Microbiology North South UniversityDhaka 1229Bangladesh Faculty of Life Sciences and Medicine Zhejiang Sci-Tech UniversityHangzhouZhejiang 310018China Faculty of Pharmacy International Islamic University MalaysiaKuantanPahang 25200Malaysia School of Biotechnology Jiangnan UniversityWuxiJiangsu 214122China Department of Biomedical Technology Tampere UniversityTampere 33014Finland Department of Genetic Engineering and Biotechnology Jashore University of Science and TechnologyJashore 7408Bangladesh Department of Genetic Engineering and Biotechnology University of ChittagongChittagong 4331Bangladesh Applied Statistics and Data Science Jahangirnagar UniversityDhaka 1342Bangladesh Department of Mathematics and Natural Sciences Brac UniversityDhaka 1212Bangladesh Department of Electrical and Electronic Engineering United International UniversityDhaka 1212Bangladesh.

Lassa hemorrhagic fever,caused by Lassa mammarenavirus(LASV)infection,accumulates up to 5000 deaths every ***,there is no vaccine available to combat this *** this study,a library of 200 bioactive compounds was virtually screened to study their drug-likeness with the capacity to block theα-dystroglycan(α-DG)receptor and prevent LASV *** rigorous absorption,distribution,metabolism,and excretion(ADME)and quantitative structure-activity relationship(QSAR)profiling,molecular docking was conducted with the top ligands against theα-DG *** compounds chrysin,reticuline,and 3-caffeoylshikimic acid emerged as the top three ligands in terms of binding ***-docking analysis revealed that interactions with Arg76,Asn224,Ser259,and Lys302 amino acid residues of the receptor protein were important for the optimum binding affinity of *** dynamics simulation was performed comprehensively to study the stability of the protein-ligand ***-depth assessment of root-mean-square deviation(RMSD),root mean square fluctuation(RMSF),polar surface area(PSA),B-Factor,radius of gyration(Rg),solvent accessible surface area(SASA),and molecular surface area(MolSA)values of the protein-ligand complexes affirmed that the candidates with the best binding affinity formed the most stable protein-ligand *** authenticate the potentialities of the ligands as target-specific drugs,an in vivo study is underway in real time as the continuation of the research.

关键词： LASV infection α-dystroglycan receptor bioactive compounds target specificity molecular docking molecular dynamic simulations

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Synthesis and electroluminescence properties of tris-[5-choloro-8-hydroxyquinoline]aluminum Al(5-Clq)_3

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Journal of Semiconductors 2015年第6期36卷 35-38页

作者： Rahul kumar parag Bhargava Ritu Srivastava Priyanka Tyagi Indian Institute of Technology Bombay National Physical Laboratory

A new electroluminescent material tris- [5-choloro-8-hydroxyquinoline] aluminum has been synthesized and characterized. Solution of this material AI（5-Clq）3 in toluene showed absorption maxima at 385 nm which was attributed to the moderate energy （π-π＊） transitions of the aromatic rings. The photoluminescence spectrum of AI（5-Clq）3 in toluene solution showed a peak at 522 nm. This material shows thermal stability up to 400 ℃. The structure of the device is ITO/0.4 wt%F4-TCNQ doped α-NPD （35 nm） / AI（5-Clq）3 （30 nm） / BCP （6 nm）/ Alq3 （30 nm） / LiF （1 nm） / A1 （150 nm）. This device exhibited a luminescence peak at 585 nm （CIE coordinates, x = 0.39, y = 0.50）. The maximum luminescence of the device was 920 Cd/m2 at 25 V. The maximum current efficiency of OLED was 0.27 Cd/A at 20 V and maximum power efficiency was 0.04 lm/W at 18 V.

关键词： organometallic compounds chemical synthesis vapour deposition photoluminescence spectroscopy electrical properties luminescence

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Fracture toughness of a rejuvenated β-Ti reinforced bulk metallic glass matrix composite

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Journal of Materials Science & Technology 2022年第11期106卷 225-235页

作者： Devashish Rajpoot R.Lakshmi Narayan Long Zhang Punit kumar Haifeng Zhang parag Tandaiya Upadrasta Ramamurty Department of Mechanical Engineering Indian Institute of Technology BombayPowaiMumbai400076India Department of Mechanical and Aerospace Engineering in Nanyang Technological University Singapore 637331Republic of Singapore Department of Materials Science and Engineering Indian Institute of Technology DelhiHauz KhasNew Delhi110016India Shi-changxu Innovation Center for Advanced Materials Institute of Metal ResearchChinese Academy of SciencesShenyang110016China Institute of Materials Research and Engineering Agency for ScienceTechnology and Research(A∗STAR)Singapore 138634Republic of Singapore

A β-Ti dendrite reinforced Zr-based bulk metallic glass composite(BMGC) was found to be brittle when cast in a large size. The reasons for the embrittlement and the effectiveness of the cryothermal cycling(CTC) treatment in restoring the mode I fracture toughness are examined. Plasticity in all the CTC treated BMGC is estimated from the distribution and occurrence of pop-ins in nanoindentation tests and by measuring the magnitude of enthalpy of relaxation(△H_(rel)) via differential scanning calorimetry(DSC). This is further validated by examining the strain-to-failure(ε_(f)) in compression tests. Mode I fracture behaviour of the as-cast embrittled BMGC and the CTC treated BMGC, which exhibits maximum plasticity, is examined. Results show that both BMGCs are equally brittle and exhibit 5 times lower notch toughness(K_(QJ))than their tougher counterpart. Post-facto imaging of the side surfaces reveals the absence of notch-tip plasticity in both BMGCs. The lack of notch tip plasticity of CTC treated BMGC, despite exhibiting signatures of plasticity in nanoindentation and higher △Hrelis rationalized by reassessing the origin of pop-ins in nanoindentation tests and describing the variations in chemical and topological short range ordering during CTC, respectively. Implications of these results in terms of improving the fracture toughness of structurally relaxed BMGCs via CTC are discussed.

关键词： Bulk metallic glass composites Fracture Rejuvenation Shear bands Microsegragation

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Towards a sustainable geoliner construction in landflls by potential blending of fly ash with kaolin clay alternative:a review with an insight to Indian scenario

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Waste Disposal and Sustainable Energy 2024年第2期6卷 243-258页

作者： Kshitij kumar Biswajit paul Department of Environmental Science and Engineering Indian Institute of Technology(Indian School of Mines)Dhanbad 826004JharkhandIndia

Electricity generated through coal-based Thermal Power Plants(TPPs)has played a pivotal role in shaping modern civiliza-tion,revolutionizing industries,and improving the quality of life for billions of people *** TPPs contribute to about 37%-40%of the global energy *** production,in turn,has a direct impact on the economy of any *** from this boon to humankind,these TPPs combusting coal as their primary fuel also have specific environmen-tal impacts,the major ones being water,air,and soil pollution due to unscientific disposal of high-quantity fly ash produced *** we can put this ash to good use,it may assist us in mitigating the pollution caused by *** there are many conventional uses of fly ash,such as a pozzolanic material in the cement industry,more pathways need to be discovered to balance the high generation quantities with ***,a detailed description of its use in potential geoliner applications is presented in this article.A geoliner or a landfill liner acts as a virtually impenetrable layer to mitigate the leachate penetration into the underneath subsoil and groundwater,thus preventing *** are presently some studies that support the use of only fly ash in such ***,the properties of the geoliners using it are not so good to significantly mitigate environmental degradation owing to its high permeability and low densification *** bentonite conventionally used has limited deposits and is mined intensively for its use as a natural *** depos-its must also be conserved,and an alternative material that may serve similar application benefits,like bentonite,must be *** desired aim can be fulfilled if we blend this combustion residue with other suitable materials(such as kaolinite clay)with low ***,the article focuses on the possibilities of blending fly ash with different clays for geoliner construction to improve the in

关键词： Fly ash-Geoliner Environmental management Composite liner systems Bentonite Kaolin clay

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Dual-Core Photonic Crystal Fiber Plasmonic Refractive Index Sensor: A Numerical Analysis

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Photonic Sensors 2019年第2期9卷 151-161页

作者： Alok kumar paul Ajay Krishno SARKAR Department of Electrical & Electronic Engineering Rajshahi University of Engineering & Technology Rajshahi-6204 Bangladesh

A numerical analysis on dual core photonic crystal fiber (DC-PCF) based surface plasmon resonance (SPR) refractive index sensor is presented. The guiding parameters and required sensing performances are examined with finite element method (FEM) based software under MATLAB environment. According to simulation, it is warranted that the proposed refractive index sensor offers the maximum amplitude sensitivity of 554.9 refractive index unit (RIU-1) and 636.5 RIU 1 with the maximum wavelength sensitivity of 5800nm/RIU and 11 500nm/RIU, and the sensor resolutions of 1.72 ×10^-5RIU and 8.7× 10^-6 RIU, at analyte refractive index (RI) of 1.40 for x- and y-polarized modes, respectively. As the sensing performance in different wavelength ranges is quite high, the proposed sensor can be used in simultaneous detection for different wavelength ranges. Therefore, the proposed device is of a suitable platform for detecting biological, chemical, biochemical, and organic chemical analytes.

关键词： Photonic crystal fiber biosensor refractive index sensor finite element method plasmonic material

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Detecting IEEE 802.11 Client Device Impersonation on a Wireless Access Point

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Journal of Communications and Information Networks 2022年第4期7卷 408-420页

作者： paul Zanna Dinesh kumar Pj Radcliffe RMIT University MelbourneAustralia

The ability to effortlessly construct and broadcast false messages makes IEEE 802.11 wireless networks particularly vulnerable to *** frame generation allows rogue devices to impersonate an authorized user and issue commands that impact the user’s network connection or possibly the entire network’s ***,the current device impersonation detection methods are unsuitable for small devices or real-time *** contribution is to demonstrate that a rule-based learning classifier using several random forest(RF)features from an IEEE 802.11 frame can determine the probability that an impersonating device has generated that frame in real *** main innovation is a processing pipeline,and the algorithm that implements concurrent one-class classifiers on a per device basis yet is lightweight enough to run directly on a wireless access point(WAP)and produce real-time outputs.

关键词： IEEE 802.11 WIFI P4 software defined radio(SDR) software defined networking(SDN) security

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Technical challenges in tackling regulatory concerns for urban atmospheric nanoparticles

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Particuology 2011年第6期9卷 566-571页

作者： Prashant kumar Alan Robins Sotiris Vardoulakis paul Quincey Division of Civil Chemical and Environmental EngineeringFaculty of Engineering and Physical Sciences(FEPS)University of Surrey Environmental Flow(EnFlo)Research Centre FEPSUniversity of Surrey Centre for Radiation Chemical and Environmental HazardsHealth Protection Agency Analytical Science Division National Physical Laboratory

Recent Euro 5 and Euro 6 vehicle emission standards are the first ever initiative to control particles on a number basis at the source. Related standards are also desirable for ambient nanoparticles （taken in this article to be those below 300 rim） to protect against possible adverse effects on public health and the environment. However, there are a number of technical challenges that need to be tackled before developing a regulatory framework for atmospheric nanoparticles. Some of the challenges derive from a lack of standardisation of the key measurement parameters, including sampling, necessary for robust evaluation of particle number concentrations, especially in the context of insufficient knowledge of the physicochemical characteristics of emerging sources （i.e. bio-fuel derived and manufactured nanoparti- cles）. Ideally, ambient concentrations of primary particles could be linked to primary particle emissions by use of nanoparticle dispersion models, and secondary nanoparticles using photochemical modeling tools. The limitations in these areas are discussed. Although there is inadequate information on the exact biological mechanism through which these particles cause harm, it is argued that this should not in itself delay the introduction of regulation. This article reviews the missing links between the existing knowledge of nanoparticle number concentrations and the advances required to tackle the technical challenges implied in developing regulations.

关键词： Airborne and manufactured nanoparticles Particle number concentrations Size distributions Street canyons Ultrafine particles Vehicle emissions

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Effects of cartilaginous rings on airflow and particle transport through simplified and realistic models of human upper respiratory tracts

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Acta Mechanica Sinica 2013年第6期29卷 883-892页

作者： Vivek kumar Srivastav Akshoy Ranjan paul Anuj Jain Department of Applied Mechanics Motilal Nehru National Institute of Technology

In the present study, computational fluid dynamics （CFD） is used to investigate inspiratory and expiratory airflow characteristics in the human upper respiratory tract for the purpose of identifying the probable locations of particle deposition and the wall injury. Computed tomography （CT） scan data was used to reconstruct a three dimensional respiratory tract from trachea to first generation bronchi. To compare, a simplified model of respiratory tract based on Weibel was also used in the study. The steady state results are obtained for an airflow rate of 45 L/min, corresponding to the heavy breathing condition. The velocity distribution, wall shear stress, static pressure and particle deposition are compared for inspiratory flows in simplified and realistic models and expiratory flows in realistic model only. The results show that the location of cartilaginous rings is susceptible to wall injury and local particle deposition.

关键词： Upper respiratory tract Cartilaginous rings Computational fluid dynamics (CFD) Computed tomogra- phy (CT) Wall shear stress Particle deposition.

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A Novel Deep Learning Based Healthcare Model for COVID-19 Pandemic Stress Analysis

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Computers, Materials & Continua 2022年第9期72卷 6029-6044页

作者： Ankur Dumka parag Verma Rajesh Singh Anil kumar Bisht Divya Anand Hani Moaiteq Aljahdali Irene Delgado Noya Silvia Aparicio Obregon Computer Science and Engineering Women Institute of TechnologyUttarakhand-248007India Chitkara University Institute of Engineering and Technology Chitkara UniversityPunjabIndia Research and Innovation Uttranchal UniversityDehradunUttrakhand248007India Department of Computer Science&IT MJP Rohilkhand UniversityBareilly236006UPIndia Computer Science and Engineering Lovely Professional UniversityPunjab144411India Higher Polytechnic School Universidad Europea del Atlántico39011SantanderSpain Faculty of Computing and Information Technology King Abdulaziz University37848JeddahSaudi Arabia Universidad Internacional Iberoamericana CampecheMexico Universidade Internacional do Cuanza Bairro Kaluanda EN 250CuitoBié.Angola

Coronavirus(COVID-19)has impacted nearly every person across the globe either in terms of losses of life or as of *** current coronavirus(COVID-19)pandemic is a rare/special situation where people can express their feelings on Internet-based social *** media is emerging as the biggest platform in recent years where people spend most of their time expressing themselves and their *** research is based on gathering data from Twitter and analyzing the behavior of the people during the COVID-19 *** research is based on the logic expressed by people in this perspective and emotions for the suffering of COVID-19 and *** this research,we have used a Long Short-Term Memory(LSTM)network model with Convolutional Neural Network using Keras python deep-learning library to determine whether social media platform users are depressed in terms of positive,negative,or neutral emotional out bust based on their Twitter *** results showed that the model has 88.14%accuracy(representation of the correct prediction over the test dataset)after 10 epochs which most tweets showed had neutral *** evaluation shows interesting results in positive(1),negative(–1),and neutral(0)emotions through different visualization.

关键词： COVID-19 lockdown stress analysis depression analysis sentiment analysis social media COVID-19 twitter dataset coronavirus

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Critical Review on Balanites aegyptiaca Delile:Phytoconstituents,Pharmacological Properties and Nanointerventions

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Chinese Journal of Integrative Medicine 2024年第7期30卷 653-663页

作者： Surendra kumar Gautam Rakesh kumar paul Devesh M.Sawant Amita Sarwal Kaisar Raza Department of Pharmacy School of Chemical Sciences and PharmacyCentral University of RajasthanBandarsindriAjmerRajasthan305817India University Institute of Pharmaceutical Sciences Panjab UniversityChandigarh160014India

Balanites aegyptiaca Delile(BA)is an enduring xerophytic woody and spinous flowering tree and is commonly known as desert date or Ingudi(Hingot).It belongs to the family Zygophyllaceae,which is specific to be drought areas of Nigeria,Africa,South Asia and India(Rajasthan).In Ayurveda,this traditional medicinal plant is reported for the management of jaundice,syphilis,yellow fever,metabolic disorders,liver,and spleen *** main aim of the review is to compile its medicinal uses and further advancements to showcase the promises inherited in various parts of the plant for the benefit of *** per the literature survey,various researchers have focused on the detailed investigation of BA including the phytopharmacological evidence,chemical constituents,nano-formulations,commercialized products,and clinical *** remarkable scaffolds and isolated compounds like diosgenin,yamogenin,balanitin1/2,balanitin 3,bal4/5,bal6/7,rutin-3-glycosides,3,7-diglycosides,(3,12,14,16)–(12-hydroxycholest-5-ene-3,16-diyl-bis)-D-glucopyranoside and balanitoside have been ***,this traditional plant has been scientifically proven by in vitro and in *** on the complete review of this plant,most of the compounds have been isolated from the fruit and kernel ***,based on the literature,a histogram was developed for pharmacological activity in which antidiabetic study was found to be more compared to other pharmacological *** a spinous desert dates,this plant needs to be explored more to bring out newer phytochemicals in the management of various diseases.

关键词： Delile desert date phytochemicals nano-phytopharmaceutical pharmacological activities traditional medicine

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