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High-throughput computational screening and in vitro evaluation identifies 5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-1H-isoindole-1,3(2H)-dione(C3),as a novel EGFR—HER2 dual inhibitor in gastric tumors

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Oncology Research 2024年第2期32卷 251-259页

作者： MESFER AL SHAHRANI REEM GAHTANI mohammad ABOHASSAN mohammad ALSHAHRANI YASSER ALRAEY AYED DERA mohammad RAJEH ASIRI PRASANNA RAJAGOPALAN Department of Clinical Laboratory Sciences College of Applied Medical SciencesKing Khalid UniversityAbhaSaudi Arabia

Gastric cancers are caused primarily due to the activation and amplification of the EGFR or HER2 kinases resulting in cell proliferation,adhesion,angiogenesis,and *** therapies are ineffective due to the intra-tumoral heterogeneity and concomitant genetic ***,dual inhibition strategies are recommended to increase potency and reduce *** this study,we have conducted computational high-throughput screening of the ChemBridge library followed by in vitro assays and identified novel selective inhibitors that have a dual impediment of EGFR/HER2 kinase ***-based High-throughput Virtual Screening(D-HTVS)was used to screen the whole ChemBridge small molecular library against EGFR and *** atomistic molecular dynamic simulation was conducted to understand the dynamics and stability of the protein-ligand ***/HER2 kinase enzymes,KATOIII,and Snu-5 cells were used for in vitro *** atomistic Molecular Dynamics simulations followed by solvent-based Gibbs binding free energy calculation of top molecules,identified compound C3(5-(4-oxo-4H-3,1-benzoxazin-2-yl)-2-[3-(4-oxo-4H-3,1-benzoxazin-2-yl)phenyl]-1H-isoindole-1,3(2H)-dione)to have a good affinity for both EGFR and *** predicted compound,C3,was promising with better binding energy,good binding pose,and optimum interactions with the EGFR and HER2 residues.C3 inhibited EGFR and HER2 kinases with IC50 values of 37.24 and 45.83 nM,*** GI50 values of C3 to inhibit KATOIII and Snu-5 cells were 84.76 and 48.26 nM,*** on these findings,we conclude that the identified compound C3 showed a conceivable dual inhibitory activity on EGFR/HER2 kinase,and therefore can be considered as a plausible lead-like molecule for treating gastric cancers with minimal side effects,though testing in higher models with pharmacokinetic approach is required.

关键词： Dual inhibitor Drug discovery EGFR/HER2 kinase Gastric cancer High-throughput screening

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Improving the Segmentation of Arabic Handwriting Using Ligature Detection Technique

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Computers, Materials & Continua 2024年第5期79卷 2015-2034页

作者： Husam Ahmad Al Hamad mohammad Shehab College of Computer Sciences and Informatics Amman Arab UniversityAmman11953Jordan

Recognizing handwritten characters remains a critical and formidable challenge within the realm of computervision. Although considerable strides have been made in enhancing English handwritten character recognitionthrough various techniques, deciphering Arabic handwritten characters is particularly intricate. This complexityarises from the diverse array of writing styles among individuals, coupled with the various shapes that a singlecharacter can take when positioned differently within document images, rendering the task more perplexing. Inthis study, a novel segmentation method for Arabic handwritten scripts is suggested. This work aims to locatethe local minima of the vertical and diagonal word image densities to precisely identify the segmentation pointsbetween the cursive letters. The proposed method starts with pre-processing the word image without affectingits main features, then calculates the directions pixel density of the word image by scanning it vertically and fromangles 30° to 90° to count the pixel density fromall directions and address the problem of overlapping letters, whichis a commonly attitude in writing Arabic texts by many people. Local minima and thresholds are also determinedto identify the ideal segmentation area. The proposed technique is tested on samples obtained fromtwo datasets: Aself-curated image dataset and the IFN/ENIT dataset. The results demonstrate that the proposed method achievesa significant improvement in the proportions of cursive segmentation of 92.96% on our dataset, as well as 89.37%on the IFN/ENIT dataset.

关键词： Arabic handwritten segmentation image processing ligature detection technique intelligent recognition

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Distributed Energy and Reserve Scheduling in Local Energy Communities Using L-BFGS Optimization

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CSEE Journal of Power and Energy Systems 2024年第3期10卷 942-952页

作者： mohammad Dolatabadi Alireza Zakariazadeh Alberto Borghetti Pierluigi Siano Department of Management&Innovation Systems University of SalernoSalernoItaly Department of Electrical Electronicand Information EngineeringUniversity of BolognaBolognaItaly University of Science and Technology of Mazandaran BehshahrIran Department of Power Systems National University of Science and Technology POLITEHNICA BucharestBucharestRomania IEEE

Encouraging citizens to invest in small-scale renewable resources is crucial for transitioning towards a sustainable and clean energy *** energy communities(LECs)are expected to play a vital role in this ***,energy scheduling in LECs presents various challenges,including the preservation of customer privacy,adherence to distribution network constraints,and the management of computational *** paper introduces a novel approach for energy scheduling in renewable-based LECs using a decentralized optimization *** proposed approach uses the Limitedmemory Broyden–Fletcher–Goldfarb–Shanno(L-BFGS)method,significantly reducing the computational effort required for solving the mixed integer programming(MIP)*** incorporates network constraints,evaluates energy losses,and enables community participants to provide ancillary services like a regulation reserve to the grid *** assess its robustness and efficiency,the proposed approach is tested on an 84-bus radial distribution *** indicate that the proposed distributed approach not only matches the accuracy of the corresponding centralized model but also exhibits scalability and preserves participant privacy.

关键词： Distributed optimization flexibility services L-BFGS method local energy community renewables reserve

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Normal Crossings Singularities for Symplectic Topology:Structures

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Acta Mathematica Sinica,English Series 2024年第1期40卷 107-160页

作者： mohammad FARAJZADEH-TEHRANI Mark MCLEAN Aleksey ZINGER The University of Iowa MacLean HallIowa CityIA 52241 Department of Mathematics Stony Brook UniversityStony BrookNY 11794

Our previous papers introduce topological notions of normal crossings symplectic divisor and variety,show that they are equivalent,in a suitable sense,to the corresponding geometric notions,and establish a topological smoothability criterion for normal crossings symplectic *** present paper constructs a blowup,a complex line bundle,and a logarithmic tangent bundle naturally associated with a normal crossings symplectic divisor and determines the Chern class of the last *** structures have applications in constructions and analysis of various moduli *** a corollary of the Chern class formula for the logarithmic tangent bundle,we refine Aluffi’s formula for the Chern class of the tangent bundle of the blowup at a complete intersection to account for the torsion and extend it to the blowup at the deepest stratum of an arbitrary normal crossings divisor.

关键词： Normal crossings divisor Chern class Logarithmic tangent bundle

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脆性材料I型(张开)-断裂韧性测定的PFC2D和试验研究:一种新方法

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Acta Mechanica Sinica 2024年第2期40卷 116-130页

作者：付金伟 Hadi Haeri Joseph FLabuz Vahab Sarfarazi Pouyan Ebneabbasi MRM Aliha Hamid reza Karimi Shirin Jahanmiri mohammad Fatehi Marji School of Civil Engineering and Transportation North China University of Water Resources and Electric PowerZhengzhou450046China Department of Mining Engineering Higher Education Complex of ZarandShahid Bahonar University of KermanKermanIran Department of Civil Environmentaland Geo-EngineeringUniversity of MinnesotaMinneapolis55455USA Department of Mining Engineering Hamedan University of TechnologyHamedanIran Research Scholar Civil Engineering DepartmentIslamic Azad UniversityHamedanIran Welding and Joining Research Center School of Industrial EngineeringIran University of Science and TechnologyNarmakTehranIran School of Civil Engineering Iran University of Science and Technology(IUST)NarmakTehranIran Department of Mine Exploitation Engineering Faculty of Mining and MetallurgyInstitute of EngineeringYazd UniversityYazdIran

在本文研究中,通过利用优势边缘缺口盘型(END)试样,确定了石灰石的断裂韧性,提出了一种新的石灰石归一化相应力、高相变的计算方法.采用柔性有限元法(FEM)对试样的I型(张开)-断裂韧性进行了精确计算,并得到了相应实用公式.在试验中,还... 详细信息

在本文研究中,通过利用优势边缘缺口盘型(END)试样,确定了石灰石的断裂韧性,提出了一种新的石灰石归一化相应力、高相变的计算方法.采用柔性有限元法(FEM)对试样的I型(张开)-断裂韧性进行了精确计算,并得到了相应实用公式.在试验中,还使用含缺口巴西圆盘(NBD)试件,测试了END程序的准确性.为了在数值上重现这些测试并验证断裂韧性测量的正确性,还对END测试进行了离散元分析.数值模拟结果与实验结果吻合良好.然而,END研究所确定的韧性水平低于NBD测试规定的韧性水平,这是因为END石灰石样品中的缺口具有均匀的拉伸应力分布.

关键词：断裂韧性脆性材料实用公式拉伸应力巴西圆盘离散元分析相变归一化

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An Improved Binary Quantum-based Avian Navigation Optimizer Algorithm to Select Effective Feature Subset from Medical Data:A COVID-19 Case Study

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Journal of Bionic Engineering 2024年第1期21卷 426-446页

作者： Ali Fatahi mohammad H.Nadimi-Shahraki Hoda Zamani Faculty of Computer Engineering Najafabad BranchIslamic Azad UniversityNajafabad ***Iran Big Data Research Center Najafabad BranchIslamic Azad UniversityNajafabad ***Iran

Feature Subset Selection(FSS)is an NP-hard problem to remove redundant and irrelevant features particularly from medical data,and it can be effectively addressed by metaheuristic ***,existing binary versions of metaheuristic algorithms have issues with convergence and lack an effective binarization method,resulting in suboptimal solutions that hinder diagnosis and prediction *** paper aims to propose an Improved Binary Quantum-based Avian Navigation Optimizer Algorithm(IBQANA)for FSS in medical data preprocessing to address the suboptimal solutions arising from binary versions of metaheuristic *** proposed IBQANA’s contributions include the Hybrid Binary Operator(HBO)and the Distance-based Binary Search Strategy(DBSS).HBO is designed to convert continuous values into binary solutions,even for values outside the[0,1]range,ensuring accurate binary *** the other hand,DBSS is a two-phase search strategy that enhances the performance of inferior search agents and accelerates *** combining exploration and exploitation phases based on an adaptive probability function,DBSS effectively avoids local *** effectiveness of applying HBO is compared with five transfer function families and thresholding on 12 medical datasets,with feature numbers ranging from 8 to 10,***'s effectiveness is evaluated regarding the accuracy,fitness,and selected features and compared with seven binary metaheuristic ***,IBQANA is utilized to detect *** results reveal that the proposed IBQANA outperforms all comparative algorithms on COVID-19 and 11 other medical *** proposed method presents a promising solution to the FSS problem in medical data preprocessing.

关键词： Feature subset selection Optimization Binary metaheuristic algorithms Bioinspired Machine learning Medical datasets

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Advances in Manta Ray Foraging Optimization:A Comprehensive Survey

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Journal of Bionic Engineering 2024年第2期21卷 953-990页

作者： Farhad Soleimanian Gharehchopogh Shafi Ghafouri mohammad Namazi Bahman Arasteh Department of Computer Engineering Urmia BranchIslamic Azad UniversityUrmiaIran Department of Computer Engineering Tabriz BranchIslamic Azad UniversityTabrizIran Department of Computer Engineering Maybod BranchIslamic Azad UniversityMaybodIran Department of Software Engineering Faculty of Engineering and Natural ScienceIstinye UniversityIstanbulTurkey

This paper comprehensively analyzes the Manta Ray Foraging Optimization(MRFO)algorithm and its integration into diverse academic *** in 2020,the MRFO stands as a novel metaheuristic algorithm,drawing inspiration from manta rays’unique foraging behaviors—specifically cyclone,chain,and somersault *** biologically inspired strategies allow for effective solutions to intricate physical *** its potent exploitation and exploration capabilities,MRFO has emerged as a promising solution for complex optimization *** utility and benefits have found traction in numerous academic *** its inception in 2020,a plethora of MRFO-based research has been featured in esteemed international journals such as IEEE,Wiley,Elsevier,Springer,MDPI,Hindawi,and Taylor&Francis,as well as at international conference *** paper consolidates the available literature on MRFO applications,covering various adaptations like hybridized,improved,and other MRFO variants,alongside optimization *** trends indicate that 12%,31%,8%,and 49%of MRFO studies are distributed across these four categories respectively.

关键词： Manta ray foraging optimization Metaheuristic algorithms Hybridization Improved Optimization

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Towards implementation of alloy-specific thermo-fluid modelling for laser powder-bed fusion of Mg alloys

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Journal of Magnesium and Alloys 2024年第6期12卷 2327-2344页

作者： mohammad Hoseini-Athar Mikael Ersson Peter Hedström Department of Material Science and Engineering KTH Royal Institute of TechnologyStockholmSE-10044 Sweden

Multi-physics thermo-fluid modeling has been extensively used as an approach to understand melt pool dynamics and defect formation as well as optimizing the process-related parameters of laser powder-bed fusion(L-PBF).However,its capabilities for being implemented as a reliable tool for material design,where minor changes in material-related parameters must be accurately captured,is still in *** the present research,first,a thermo-fluid computational fluid dynamics(CFD)model is developed and validated against experimental *** the predicted material properties of the pure Mg and commercial ZK60 and WE43 Mg alloys,parametric studies are done attempting to elucidate how the difference in some of the material properties,i.e.,saturated vapor pressure,viscosity,and solidification range,can influence the melt pool *** is found that a higher saturated vapor pressure,associated with the ZK60 alloy,leads to a deeper unstable keyhole,increasing the keyhole-induced porosity and evaporation mass *** viscosity and wider solidification range can increase the non-uniformity of temperature and velocity distribution on the keyhole walls,resulting in increased keyhole instability and formation of ***,the WE43 alloy showed the best behavior in terms of defect formation and evaporation mass loss,providing theoretical support to the extensive use of this alloy in *** summary,this study suggests an approach to investigate the effect of materials-related parameters on L-PBF melting and solidification,which can be extremely helpful for future design of new alloys suitable for L-PBF.

关键词： Mg alloys Laser powder-bed fusion(L-PBF) Melt pool dynamics Computational fluid dynamics Fluid flow

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Transient Stability Analysis of Grid-connected Converters in Wind Turbine Systems Based on Linear Lyapunov Function and Reverse-time Trajectory

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Journal of Modern Power Systems and Clean Energy 2024年第3期12卷 782-790页

作者： mohammad Kazem Bakhshizadeh Sujay Ghosh Guangya Yang Łukasz Kocewiak Ørsted Wind Power A/S Nesa Allé12820Denmark Technical University of Denmark Anker Engelunds Vej 12800Denmark

As the proportion of converter-interfaced renewable energy resources in the power system is increasing,the strength of the power grid at the connection point of wind turbine generators(WTGs)is gradually *** research has shown that when connected with the weak grid,the stability of the traditional grid-following controlled converters will deteriorate,and they are prone to unstable phenomena such as *** to the limitations of linear analysis that cannot sufficiently capture the stability phenomena,transient stability must be *** far,standalone time-domain simulations or analytical Lyapunov stability criteria have been used to investigate transient ***,the time-domain simulations have proven to be computationally too heavy,while analytical methods are difficult to formulate for larger systems,require many modelling assumptions,and are often conservative in estimating the stability *** paper proposes and demonstrates an innovative approach to estimating the transient stability boundary via combining the linear Lyapunov function and the reverse-time trajectory *** proposed methodology eliminates the need of time-consuming simulations and the conservative nature of Lyapunov *** study brings out the clear distinction between the stability boundaries with different post-fault active current ramp rate *** the same time,it provides a new perspective on critical clearing time for wind turbine *** stability boundary is verified using time-domain simulation studies.

关键词： Lyapunov direct method non-autonomous system phase-locked loop(PLL) time trajectory reversal transient stability assessment wind turbine converter system

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The anti-neoplastic effects of metformin modulate the acquired phenotype of fbroblast cells in the breast cancer-normal fbroblast co-culture system

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Oncology Research 2024年第3期32卷 477-487页

作者： SAMANEH MOSTAFAVI ZUHAIR mohammad HASSAN Department of Immunology Faculty of Medical SciencesTarbiat Modares UniversityTehranIran

Intracellular communications between breast cancer and fibroblast cells were reported to be involved in cancer proliferation,growth,and therapy *** hallmarks of cancer fibroblast interactions,consisting of caveolin 1(Cav1)and mono-carboxylate ransporter 4(MCT4)(metabolic coupling markers),along with IL-6,TGFB,and lactate secretion,are considered robust biomarkers predicting recurrence and *** order to promote a novel phenotype in normal fibroblasts,we predicted that breast cancer cells could be able to cause loss of Cavl and increase of MCT4,as well as elevate IL 6 and TGF in nearby nomal *** created a co culture model using breast cancer(4T1)and normal fibroblast(NIH3T3)cell lines cultured under specific experimental conditions in order to directly test our ***,we show that long-term co-culture of breast cancer cells and normal fibroblasts promotes loss of Cavl and gain of MCT4 in adjacent fibroblasts and increase lactate *** results were validated using the monoculture of each group separately as a *** this system,we show that me tformin inhibits IL-6 and TGFB secretion and re expresses Cavl in both ***,MCT4 and lactate stayed high after treatment with *** conclusion,our work shows that co-culture with breast cancer cells may cause signifcant alterations in the phenotype and secretion of normal ***,however,may change this state and affect fibroblasts'acquired ***,mitochondrial inhibition by metformin after 8 days of treatment,signi ficantly hinders tumor growth in mouse model of breast cancer.

关键词： Caveolin 1 Lactic acid Metformin NIH 3T3 cells Neoplasms

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