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Insights and analysis of machine learning for benzene hydrogenation to cyclohexene
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作者 SUN Chao ZHANG Bin 《燃料化学学报(中英文)》 北大核心 2026年第2期133-139,共7页
Cyclohexene is an important raw material in the production of nylon.Selective hydrogenation of benzene is a key method for preparing cyclohexene.However,the Ru catalysts used in current industrial processes still face... Cyclohexene is an important raw material in the production of nylon.Selective hydrogenation of benzene is a key method for preparing cyclohexene.However,the Ru catalysts used in current industrial processes still face challenges,including high metal usage,high process costs,and low cyclohexene yield.This study utilizes existing literature data combined with machine learning methods to analyze the factors influencing benzene conversion,cyclohexene selectivity,and yield in the benzene hydrogenation to cyclohexene reaction.It constructs predictive models based on XGBoost and Random Forest algorithms.After analysis,it was found that reaction time,Ru content,and space velocity are key factors influencing cyclohexene yield,selectivity,and benzene conversion.Shapley Additive Explanations(SHAP)analysis and feature importance analysis further revealed the contribution of each variable to the reaction outcomes.Additionally,we randomly generated one million variable combinations using the Dirichlet distribution to attempt to predict high-yield catalyst formulations.This paper provides new insights into the application of machine learning in heterogeneous catalysis and offers some reference for further research. 展开更多
关键词 machine learning heterogeneous catalysis hydrogenation of benzene XGBoost
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Heterogeneous User Authentication and Key Establishment Protocol for Client-Server Environment
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作者 Huihui Zhu Fei Tang +1 位作者 Chunhua Jin Ping Wang 《Computers, Materials & Continua》 2026年第4期648-666,共19页
The ubiquitous adoption of mobile devices as essential platforms for sensitive data transmission has heightened the demand for secure client-server communication.Although various authentication and key agreement proto... The ubiquitous adoption of mobile devices as essential platforms for sensitive data transmission has heightened the demand for secure client-server communication.Although various authentication and key agreement protocols have been developed,current approaches are constrained by homogeneous cryptosystem frameworks,namely public key infrastructure(PKI),identity-based cryptography(IBC),or certificateless cryptography(CLC),each presenting limitations in client-server architectures.Specifically,PKI incurs certificate management overhead,IBC introduces key escrow risks,and CLC encounters cross-system interoperability challenges.To overcome these shortcomings,this study introduces a heterogeneous signcryption-based authentication and key agreement protocol that synergistically integrates IBC for client operations(eliminating PKI’s certificate dependency)with CLC for server implementation(mitigating IBC’s key escrow issue while preserving efficiency).Rigorous security analysis under the mBR(modified Bellare-Rogaway)model confirms the protocol’s resistance to adaptive chosen-ciphertext attacks.Quantitative comparisons demonstrate that the proposed protocol achieves 10.08%–71.34%lower communication overhead than existing schemes across multiple security levels(80-,112-,and 128-bit)compared to existing protocols. 展开更多
关键词 User authentication key establishment CLIENT-SERVER HETEROGENEOUS SECURITY
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Robust and Biodegradable Heterogeneous Electronics with Customizable Cylindrical Architecture for Interference-Free Respiratory Rate Monitoring
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作者 Jing Zhang Wenqi Wang +9 位作者 Sanwei Hao Hongnan Zhu Chao Wang Zhouyang Hu Yaru Yu Fangqing Wang Peng Fu Changyou Shao Jun Yang Hailin Cong 《Nano-Micro Letters》 2026年第1期914-934,共21页
A rapidly growing field is piezoresistive sensor for accurate respiration rate monitoring to suppress the worldwide respiratory illness.However,a large neglected issue is the sensing durability and accuracy without in... A rapidly growing field is piezoresistive sensor for accurate respiration rate monitoring to suppress the worldwide respiratory illness.However,a large neglected issue is the sensing durability and accuracy without interference since the expiratory pressure always coupled with external humidity and temperature variations,as well as mechanical motion artifacts.Herein,a robust and biodegradable piezoresistive sensor is reported that consists of heterogeneous MXene/cellulose-gelation sensing layer and Ag-based interdigital electrode,featuring customizable cylindrical interface arrangement and compact hierarchical laminated architecture for collectively regulating the piezoresistive response and mechanical robustness,thereby realizing the long-term breath-induced pressure detection.Notably,molecular dynamics simulations reveal the frequent angle inversion and reorientation of MXene/cellulose in vacuum filtration,driven by shear forces and interfacial interactions,which facilitate the establishment of hydrogen bonds and optimize the architecture design in sensing layer.The resultant sensor delivers unprecedented collection features of superior stability for off-axis deformation(0-120°,~2.8×10^(-3) A)and sensing accuracy without crosstalk(humidity 50%-100%and temperature 30-80).Besides,the sensor-embedded mask together with machine learning models is achieved to train and classify the respiration status for volunteers with different ages(average prediction accuracy~90%).It is envisioned that the customizable architecture design and sensor paradigm will shed light on the advanced stability of sustainable electronics and pave the way for the commercial application in respiratory monitory. 展开更多
关键词 Wearable electronics Piezoresistive sensor HETEROGENEOUS CELLULOSE Respiratory monitoring
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Blockchain and Smart Contracts with Barzilai-Borwein Intelligence for Industrial Cyber-Physical System
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作者 Gowrishankar Jayaraman Ashok Kumar Munnangi +2 位作者 Ramesh Sekaran Arunkumar Gopu Manikandan Ramachandran 《Computers, Materials & Continua》 2026年第3期916-935,共20页
Industrial Cyber-Physical Systems(ICPSs)play a vital role in modern industries by providing an intellectual foundation for automated operations.With the increasing integration of information-driven processes,ensuring ... Industrial Cyber-Physical Systems(ICPSs)play a vital role in modern industries by providing an intellectual foundation for automated operations.With the increasing integration of information-driven processes,ensuring the security of Industrial Control Production Systems(ICPSs)has become a critical challenge.These systems are highly vulnerable to attacks such as denial-of-service(DoS),eclipse,and Sybil attacks,which can significantly disrupt industrial operations.This work proposes an effective protection strategy using an Artificial Intelligence(AI)-enabled Smart Contract(SC)framework combined with the Heterogeneous Barzilai-Borwein Support Vector(HBBSV)method for industrial-based CPS environments.The approach reduces run time and minimizes the probability of attacks.Initially,secured ICPSs are achieved through a comprehensive exchange of views on production plant strategies for condition monitoring using SC and blockchain(BC)integrated within a BC network.The SC executes the HBBSV strategy to verify the security consensus.The Barzilai-Borwein Support Vectorized algorithm computes abnormal attack occurrence probabilities to ensure that components operate within acceptable production line conditions.When a component remains within these conditions,no security breach occurs.Conversely,if a component does not satisfy the condition boundaries,a security lapse is detected,and those components are isolated.The HBBSV method thus strengthens protection against DoS,eclipse,and Sybil attacks.Experimental results demonstrate that the proposed HBBSV approach significantly improves security by enhancing authentication accuracy while reducing run time and authentication time compared to existing techniques. 展开更多
关键词 Industrial CPS security artificial intelligence blockchain smart contract heterogeneous
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CamSimXR:eXtended Reality(XR)Based Pre-Visualization and Simulation for Optimal Placement of Heterogeneous Cameras
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作者 Juhwan Kim Gwanghyun Jo Dongsik Jo 《Computers, Materials & Continua》 2026年第3期1920-1939,共20页
In recent years,three-dimensional reconstruction technologies that employ multiple cameras have continued to evolve significantly,enabling remote collaboration among users in extended Reality(XR)environments.In additi... In recent years,three-dimensional reconstruction technologies that employ multiple cameras have continued to evolve significantly,enabling remote collaboration among users in extended Reality(XR)environments.In addition,methods for deploying multiple cameras for motion capture of users(e.g.,performers)are widely used in computer graphics.As the need to minimize and optimize the number of cameras grows to reduce costs,various technologies and research approaches focused on Optimal Camera Placement(OCP)are continually being proposed.However,as most existing studies assume homogeneous camera setups,there is a growing demand for studies on heterogeneous camera setups.For instance,technical demands keep emerging in scenarios with minimal camera configurations,especially regarding cost factors,the physical placement of cameras given the spatial structure,and image capture strategies for heterogeneous cameras,such as high-resolution RGB cameras and depth cameras.In this study,we propose a pre-visualization and simulation method for the optimal placement of heterogeneous cameras in XR environments,accounting for both the specifications of heterogeneous cameras(e.g.,field of view)and the physical configuration(e.g.,wall configuration)in real-world spaces.The proposed method performs a visibility analysis of cameras by considering each camera’s field-of-view volume,resolution,and unique characteristics,along with physicalspace constraints.This approach enables the optimal position and rotation of each camera to be recommended,along with the minimum number of cameras required.In the results of our study conducted in heterogeneous camera combinations,the proposed method achieved 81.7%~82.7%coverage of the target visual information using only 2~3 cameras.In contrast,single(or homogeneous)-typed cameras were required to use 11 cameras for 81.6%coverage.Accordingly,we found that camera deployment resources can be reduced with the proposed approaches. 展开更多
关键词 Optimal camera placement heterogeneous cameras extended reality pre-visualization simulation multi-cameras
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FedDPL:Federated Dynamic Prototype Learning for Privacy-Preserving Malware Analysis across Heterogeneous Clients
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作者 Danping Niu Yuan Ping +2 位作者 Chun Guo Xiaojun Wang Bin Hao 《Computers, Materials & Continua》 2026年第3期1989-2014,共26页
With the increasing complexity of malware attack techniques,traditional detection methods face significant challenges,such as privacy preservation,data heterogeneity,and lacking category information.To address these i... With the increasing complexity of malware attack techniques,traditional detection methods face significant challenges,such as privacy preservation,data heterogeneity,and lacking category information.To address these issues,we propose Federated Dynamic Prototype Learning(FedDPL)for malware classification by integrating Federated Learning with a specifically designed K-means.Under the Federated Learning framework,model training occurs locally without data sharing,effectively protecting user data privacy and preventing the leakage of sensitive information.Furthermore,to tackle the challenges of data heterogeneity and the lack of category information,FedDPL introduces a dynamic prototype learning mechanism,which adaptively adjusts the clustering prototypes in terms of position and number.Thus,the dependency on predefined category numbers in typical K-means and its variants can be significantly reduced,resulting in improved clustering performance.Theoretically,it provides a more accurate detection of malicious behavior.Experimental results confirm that FedDPL excels in handling malware classification tasks,demonstrating superior accuracy,robustness,and privacy protection. 展开更多
关键词 Malware classification data heterogeneity federated learning CLUSTERING differential privacy
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Alkyl Alcohol Chain-length Mediated Steric Hindrance at Support Surface in Heterogeneous α-Diimine Ni Catalysts for Modulating Ethylene Polymerization
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作者 Fan Yu Bin Dai +2 位作者 Ning Liu Bin-Yuan Liu Chen Zou 《Chinese Journal of Polymer Science》 2026年第2期331-340,I0007,共11页
Heterogeneous polymerization represents a widely employed method in the polyolefin industry.In recent years,various heterogenization strategies for late transition metal catalysts have been developed,enabling effectiv... Heterogeneous polymerization represents a widely employed method in the polyolefin industry.In recent years,various heterogenization strategies for late transition metal catalysts have been developed,enabling effective control of polymer morphology and optimization of catalytic performance.However,while most studies have focused on designing anchoring groups and advancing support approaches,systematic investigations into how the support influences the catalytic behavior of the late transition metal catalysts.In this work,we fabricated supported α-diimine nickel catalysts by functionalizing the ligand with alkyl alcohol chains of varying lengths and supporting them onto MgCl_(2)supports.The ethylene polymerization behavior of these catalysts was then investigated.By precisely adjusting the alkyl alcohol chain length,the distance between the catalytically active metal center and the support surface was modulated.This approach demonstrates that support-induced steric hindrance effect can be effectively regulated by controlling the separation distance between the metal center and the support surface. 展开更多
关键词 Ethylene polymerization Ni catalysts Α-DIIMINE Heterogeneous polymerization POLYETHYLENE
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Advancing sustainable chemistry through organic electrosynthesis:a perspective
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作者 Yatao Wang Jiayu Hu +1 位作者 Li Zeng Aiwen Lei 《Science China Chemistry》 2026年第2期640-658,共19页
Due to the advantages of green and sustainable chemistry,electrochemistry has attracted considerable interest from researchers in both academia and industry.Organic electrosynthesis has become a revolutionary strategy... Due to the advantages of green and sustainable chemistry,electrochemistry has attracted considerable interest from researchers in both academia and industry.Organic electrosynthesis has become a revolutionary strategy,which offers a greener and more energy-efficient option for traditional organic synthesis.This mini review summarizes examples of organic electrosynthesis that highlight the unique potential of organic electrosynthesis in asymmetric electrocatalysis,photoelectrocatalysis,heterogeneous electrocatalysis,and alternating current electrolysis,aiming to stimulate future progress in this rapidly evolving area. 展开更多
关键词 alternating current asymmetric catalysis PHOTOELECTROCHEMISTRY heterogeneous electrocatalysis
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GPU‑accelerated Monte Carlo method for dose calculation of mesh‑type computational phantoms
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作者 Shu‑Chang Yan Rui Qiu +3 位作者 Xi‑Yu Luo An‑Kang Hu Zhen Wu Jun‑Li Li 《Nuclear Science and Techniques》 2026年第1期297-308,共12页
Computational phantoms play an essential role in radiation dosimetry and health physics.Although mesh-type phantoms offer a high resolution and adjustability,their use in dose calculations is limited by their slow com... Computational phantoms play an essential role in radiation dosimetry and health physics.Although mesh-type phantoms offer a high resolution and adjustability,their use in dose calculations is limited by their slow computational speed.Progress in heterogeneous computing has allowed for substantial acceleration in the computation of mesh-type phantoms by utilizing hardware accelerators.In this study,a GPU-accelerated Monte Carlo method was developed to expedite the dose calculation for mesh-type computational phantoms.This involved designing and implementing the entire procedural flow of a GPUaccelerated Monte Carlo program.We employed acceleration structures to process the mesh-type phantom,optimized the traversal methodology,and achieved a flattened structure to overcome the limitations of GPU stack depths.Particle transport methods were realized within the mesh-type phantom,encompassing particle location and intersection techniques.In response to typical external irradiation scenarios,we utilized Geant4 along with the GPU program and its CPU serial code for dose calculations,assessing both computational accuracy and efficiency.In comparison with the benchmark simulated using Geant4 on the CPU using one thread,the relative differences in the organ dose calculated by the GPU program predominantly lay within a margin of 5%,whereas the computational time was reduced by a factor ranging from 120 to 2700.To the best of our knowledge,this study achieved a GPU-accelerated dose calculation method for mesh-type phantoms for the first time,reducing the computational time from hours to seconds per simulation of ten million particles and offering a swift and precise Monte Carlo method for dose calculation in mesh-type computational phantoms. 展开更多
关键词 GPU Monte Carloference Mesh-type phantom External exposure Heterogeneous
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Control of ash yield on vertical pore structure development and its impact on coalbed methane adsorption in the deep coal seams of the Ordos Basin
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作者 Runye Han Hua Wang +5 位作者 Yan Liu Cheng Li Xiangchun Chang Lingyu Zhao Shangbin Wang Junjian Zhang 《Natural Gas Industry B》 2026年第1期9-29,共21页
The vertical heterogeneity of the pore structure in deep coal seams with varying ash yields is a key control for coalbed methane storage and producibility;however,its specific impact on gas adsorption is not clearly d... The vertical heterogeneity of the pore structure in deep coal seams with varying ash yields is a key control for coalbed methane storage and producibility;however,its specific impact on gas adsorption is not clearly defined.The focus of this study is the No.8 coal seam of the Carboniferous Benxi Formation in the Central-Eastern Ordos Basin.By integrating microscopic identification,proximate analysis,gas adsorption(CO_(2),N_(2),and CH_(4)),and the multifractal theory,we quantitatively characterized the nanopore structure(micropores<2 nm and mesopores 2 nm-100 nm)of coal reservoirs with varying ash yields.The results indicate that(1)ash yield is the primary factor that controls the vertical evolution of pore structures in coal seams.In low-ash yield coal seams,the extent of thermal evolution and ash yield jointly constrain the heterogeneity of pore size distribution.In mediumto high-ash yield coal seams,the heterogeneity of pore structure and pore size distribution are predominantly constrained by ash yield.(2)As the ash yield vertically increases,the mesoporous pore volume and specific surface area initially decrease and subsequently increase,while the contribution of micropores to both pore volume and specific surface area continuously diminishes.Consequently,the total pore volume and specific surface area of the coal samples exhibit a two-stage reduction close to an ash yield threshold of approximately 20%.(3)Further,the Langmuir volume for CH_(4)adsorption sharply declines below the 20%threshold,followed by a gradual decrease;in contrast,the Langmuir pressure initially decreases and subsequently increases.Hence,the vertical increase in ash yield constrains the development of pore systems and diminishes pore connectivity,thereby reducing methane adsorption capacity and adversely affecting coalbed methane productivity.(4)Low-ash yield coal reservoirs are characterized by a rapid gas breakthrough and high productivity,whereas medium-ash yield coal reservoirs generally require prolonged depressurization to achieve peak gas production.These findings reveal that in medium-high rank coal,ash yield―and not thermal evolution―is the main factor that controls vertical pore evolution and methane adsorption efficiency.The quantitative ash yield threshold(20%)established in this study provides a practical criterion for evaluating reservoir quality and predicting vertical variations in gas storage potential in the Ordos Basin. 展开更多
关键词 Ash yields Pore structure MULTIFRACTAL Vertical heterogeneity Deep coal seam Ordos Basin
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Establishment and development of mantle geochemistry
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作者 Lihui CHEN Xiaoyu ZHANG Jian ZHAO 《Science China Earth Sciences》 2026年第2期831-838,共8页
Mantle geochemistry,a field that emerged in the mid-1970s,utilizes geochemical approaches to investigate the chemical composition and structure as well as the evolution and dynamics of Earth’s mantle.Since its establ... Mantle geochemistry,a field that emerged in the mid-1970s,utilizes geochemical approaches to investigate the chemical composition and structure as well as the evolution and dynamics of Earth’s mantle.Since its establishment,this field has become a key part of solid Earth Science and Planetary Science,demonstrating great vitality.The development of its theoretical framework began with the observation of mantle heterogeneity revealed by the radiogenic isotopic compositions of ocean island basalts(OIBs)and mid-ocean ridge basalts(MORBs),which in turn gave rise to the classic“crustal recycling”model.Based on this,a suite of globally representative mantle end-member components,namely DMM(Depleted MORB Mantle),EMI(Enriched Mantle I),EMII(Enriched Mantle II),HIMU(Highμ,μ=^(238)U/^(204)Pb)and PREMA(prevalent mantle),was identified,thereby establishing a comprehensive framework to characterize the geochemical structure and geodynamic system of the mantle.Over the past five decades,mantle geochemistry has advanced with new analytical techniques and theoretical development,greatly broadening its scope.It is now a key field within the Earth System Sciences,crucial for developing models of deep material cycling and surface environmental responses.Aiming to review the development of mantle geochemistry,this paper analyzes eight seminal studies focused on radiogenic isotopes,revisiting the establishment and evolution of mantle geochemistry,exploring the scientific vision of pioneers and highlighting the key topics that define this discipline. 展开更多
关键词 Mantle heterogeneity Crustal recycling Mantle endmember Chemical geodynamics
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MimicStudio:One-Stop Development Framework for Dynamic Heterogeneous Redundancy Architecture
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作者 Hu Jingjing Li Yu +3 位作者 Sun Yuanhang Yu Bo Liu Qinrang Wu Jiangxing 《China Communications》 2026年第1期125-139,共15页
Fault-tolerant systems are crucial for ensuring the reliability and availability of missioncritical applications in modern computing environments.The dynamic heterogeneous redundancy(DHR)architecture is a key componen... Fault-tolerant systems are crucial for ensuring the reliability and availability of missioncritical applications in modern computing environments.The dynamic heterogeneous redundancy(DHR)architecture is a key component in constructing fault-tolerant systems,particularly in areas such as national security,power networks,and banking private networks.DHR is transforming the cyberspace security industry chain by accommodating a broader range of applications and increasingly capturing the market.However,the development of applications for DHR architecture encounters challenges due to the complexities of handling heterogeneity,managing dynamism,and maintaining usability.To address these issues,we introduce MimicStudio,a comprehensive development framework with a standardized workflow.To our knowledge,MimicStudio is the first effective solution for DHR software development.We present a detailed implementation of MimicStudio with a heterogeneous microcontroller unit project,encompassing three CPUs with different instruction set architectures.The paper evaluates MimicStudio’s support for essential features,including zero-copy synchronization,parallelized build,multi-core collaborative debugging,and dynamic adjustment of the software system’s structure.Our results show that MimicStudio provides a flexible and efficient solution for supporting the dynamic,heterogeneous,and redundant features of fault-tolerant systems. 展开更多
关键词 cyberspace security development enviroment dynamic heterogeneous redundancy architecture endogenous security MimicStudio
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Coupled thermo-hydro-mechanical-damage modeling of cold-water injection in deep geothermal reservoirs
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作者 Liyuan Liu Yaohui Li +3 位作者 Wenzhuo Cao Tao Wang Le Zhang Xianhui Feng 《Journal of Rock Mechanics and Geotechnical Engineering》 2026年第1期39-54,共16页
Rock damage significantly affects coupled thermo-hydro-mechanical(THM)behavior in deep geothermal exploitation through changing thermal and hydrological properties of rocks.For this,a thermo-hydro-mechanical-damage(TH... Rock damage significantly affects coupled thermo-hydro-mechanical(THM)behavior in deep geothermal exploitation through changing thermal and hydrological properties of rocks.For this,a thermo-hydro-mechanical-damage(THMD)coupled model was developed to describe the coupling between rock damage and mechanical,fluid flow and heat transfer fields.The model considers rock heterogeneity,and incorporates the Mohr-Coulomb failure criterion and the maximum tensile stress criterion to evaluate shear and tensile damage.This numerical modeling methodology was first verified against analytical solutions and experimental results,and was then used to simulate the THMD coupling behavior in deep geothermal exploitation.A coupled numerical model was set up to simulate the geothermal fluids extraction and re-injection process in a reservoir at 1 km depth over a 7-year period.Rock damage was found to accelerate the propagation of cold fronts away from the injection well,and have a distinct effect on the performance of geothermal exploitation.When the rock damage was considered,the field injectivity increases by 8.4 times,the range of cooled regions increases by 18.6 times,and the vertical deformation changes by 1.2 times after 7 years of geothermal operations,compared to the scenario where it was not considered.Parametric studies have suggested that thermal contraction dominates the rock damage evolution,and that thermal-induced rock damage only occurs at a sufficiently large temperature difference between fluids injected and the reservoir.This work underscores the importance of accurately accounting for the damage effect on reservoir response during fluid injection activities that cause significant cooling of reservoir rocks. 展开更多
关键词 Thermo-hydro-mechanical-damage (THMD)coupling Rock heterogeneity Geothermal reservoir Rock damage
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Single-cell Sequencing:Application in the Study of Disseminated Tumour Cells and Breast Cancer Treatment
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作者 Mingyue Wang 《Proceedings of Anticancer Research》 2026年第1期48-53,共6页
Breast cancer is a malignant tumor originating from breast epithelial tissue.In essence,breast epithelial cells undergo gene mutation under the influence of carcinogenic factors,leading to abnormal cell proliferation ... Breast cancer is a malignant tumor originating from breast epithelial tissue.In essence,breast epithelial cells undergo gene mutation under the influence of carcinogenic factors,leading to abnormal cell proliferation and loss of organism regulation,ultimately leading to the formation of tumors with invasive and metastatic capabilities.Carcinogenic factors of breast cancer involve multiple cellular and molecular mechanisms.Among them,disseminated tumor cells(DTCs)are considered important for treating breast cancer.However,traditional bulk sequencing techniques have limitations,such as the inability to distinguish individual cell differences and dilution of information from key cell subpopulations(such as cancer stem cells and rare immune cells).Single-cell sequencing(scRNA-seq)overcomes the heterogeneity of tumors that traditional sequencing cannot capture by analysing the molecular characteristics of single cells,providing a highresolution perspective for precise typing of breast cancer,exploration of the mechanism of the microenvironment,and personalized treatment.Through this technology,researchers can identify specific gene expression profiles of different cell subpopulations,thus providing a new basis for the molecular typing and personalized treatment of breast cancer.This article explains how single-cell sequencing is used to describe the origin of disseminated tumor cells(DTCs),analyse tumor heterogeneity,metastasis,etc.,and review the current literature on the use of scRNA-seq in breast cancer treatment.In the future,cell separation and processing steps in single-cell sequencing will be further improved to ensure the accuracy of the results and broader application in clinical diagnosis and treatment. 展开更多
关键词 Disseminated tumor cells Tumor heterogeneity analysis Single-cell sequencing METASTASIS scRNA-seq method
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Toward general and reactive machine learning potentials for heterogeneous catalysis
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作者 Wei-Xue Li 《Science China Chemistry》 2026年第2期531-532,共2页
Heterogeneous catalysis is a complex,multiscale phenomenon in which reactions occur at dynamically evolving surfaces.A longstanding goal is to probe these processes to distill design rules for novel catalytic material... Heterogeneous catalysis is a complex,multiscale phenomenon in which reactions occur at dynamically evolving surfaces.A longstanding goal is to probe these processes to distill design rules for novel catalytic materials,a capability that is essential to the transition toward a sustainable future[1–3]. 展开更多
关键词 GENERAL REACTIVE machine probe processes heterogeneous catalysis transition toward sustainable future learning distill design rules
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Bipartite Containment Control of Heterogeneous Nonlinear Multi-Agent Systems over Multi-Group Networks
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作者 HU Ziqi KANG Jianling 《Journal of Donghua University(English Edition)》 2026年第1期80-90,共11页
The bipartite containment control problem for heterogeneous nonlinear multi-agent systems(HNMASs)within multi-group networks under signed digraphs is investigated,where the first-order and second-order nonlinear dynam... The bipartite containment control problem for heterogeneous nonlinear multi-agent systems(HNMASs)within multi-group networks under signed digraphs is investigated,where the first-order and second-order nonlinear dynamic agents belong to distinct groups.Interactions are cooperative-antagonistic within each group and sign-in-degree balanced across the inter-groups.Firstly,a state feedback control protocol is designed to ensure that the trajectories of followers in diverse groups can converge to distinct convex hulls formed by their corresponding leaders,respectively.As an extension,the bipartite control problem with time-variant formation for the multi-agent system(MAS)is also considered,and a corresponding control protocol with formation compensation vectors is given.Finally,in view of Lyapunov stability theory and matrix inequality,the sufficient conditions for realizing the bipartite containment control are obtained,and several simulations are provided to verify the validity of the above methods. 展开更多
关键词 bipartite containment control time-variant formation heterogeneous nonlinear system multi-group network
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Molecular Simulations of Dynamic Heterogeneity of Segment Motion and Bond Exchange in Polymer Vitrimers
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作者 Lang Shuai Jiang-Long Li +4 位作者 Jian-Long Wen Ying-Ying Xu Shui Yu Bo-Yu Ding Yi-Jing Nie 《Chinese Journal of Polymer Science》 2026年第1期242-255,I0017,共15页
Vitrimers belong to a class of polymeric materials capable of bond exchange reactions,showing great promise for environmental protection and sustainable development.However,studies on the coupling mechanism between th... Vitrimers belong to a class of polymeric materials capable of bond exchange reactions,showing great promise for environmental protection and sustainable development.However,studies on the coupling mechanism between the bond exchange kinetics and segmental dynamics near the glass transition temperature(T_(g))remain scarce.Herein,we employed molecular dynamics simulations to investigate the dynamic heterogeneity of the segment motion and bond exchange in vitrimers.The simulation results revealed that the bond exchange energy barrier exerts a much stronger influence on the bond exchange kinetics than on the segmental dynamics.At lower temperatures,slower segmental relaxation further constraind the bond exchange rate.Additionally,increasing the bond exchange energy barrier markedly enhanced the dynamic heterogeneity of segment motion.A close correlation was observed between heterogeneity and bond exchange.This study elucidated the coupling mechanism between bond exchange and segmental dynamics at the molecular scale,thereby providing a theoretical basis for designing vitrimer materials with tunable dynamic properties. 展开更多
关键词 Molecular dynamics simulations Vitrimers Dynamic heterogeneity
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Molecular mosaic of colorectal cancer:Why one classification system is no longer enough?
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作者 Sunita Ahlawat Sumanta Das 《World Journal of Gastrointestinal Oncology》 2026年第1期8-14,共7页
Colorectal cancer(CRC)is one of the most molecularly heterogeneous malignancies,with complexity that extends far beyond traditional histopathological classifications.The consensus molecular subtypes(CMS)established in... Colorectal cancer(CRC)is one of the most molecularly heterogeneous malignancies,with complexity that extends far beyond traditional histopathological classifications.The consensus molecular subtypes(CMS)established in 2015 brought a marked advancement in the taxonomy of CRC,consolidating six classification systems into four novel subtypes,which focus on vital gene expression patterns and clinical and prognostic outcomes.However,nearly a decade of clinical experience with CMS classification has revealed fundamental limitations that underscore the inadequacy of any single classification system for capturing the full spectrum of CRC biology.The inherent challenges of the current paradigm are multifaceted.In the CMS classification,mixed phenotypes that remain unclassifiable constitute 13%of CRC cases.This reflects the remarkable heterogeneity that CRC shows.The tumor budding regions reflect the molecular shift due to CMS 2 to CMS 4 switching,causing further heterogeneity.Moreover,the reliance on bulk RNA sequencing fails to capture the spatial organization of molecular signatures within tumors and the critical contributions of the tumor microenvironment.Recent technological advances in spatial transcriptomics,singlecell RNA sequencing,and multi-omic integration have revealed the limitations of transcriptome-only classifications.The emergence of CRC intrinsic subtypes that attempt to remove microenvironmental contributions,pathway-derived subtypes,and stem cell-based classifications demonstrates the field’s recognition that multiple complementary classification systems are necessary.These newer molecular subtypes are not discrete categories but biological continua,thus highlighting that the vast molecular landscape is a tapestry of interlinked features,not rigid subtypes.Multiple technical hurdles cause difficulty in implementing the clinical translation of these newer molecular subtypes,including gene signature complexity,platform-dependent variations,and the difficulty of getting and preserving fresh frozen tissue.CMS 4 shows a poor prognostic outcome among the CMS subtypes,while CMS 1 is associated with poor survival in metastatic cases.However,the predictive value for definitive therapy remains subdued.Looking forward,the integration of artificial intelligence,liquid biopsy approaches,and real-time molecular monitoring promises to enable dynamic,multi-dimensional tumor characterization.The temporal and spatial complexity can only be captured by complementary molecular taxonomies rather than a single,unified system of CRC classification.Such an approach recognizes that different clinical questions–prognosis,treatment selection,resistance prediction–may require different molecular lenses,each optimized for specific clinical applications.This editorial advocates for a revolutionary change from pursuing a single“best”classification system toward a diverse approach that welcomes the molecular mosaic of CRC.Only through such comprehensive molecular characterization can we hope to achieve the promise of precision oncology for the diverse spectrum of patients with CRC. 展开更多
关键词 Consensus molecular subtypes HETEROGENEITY Colorectal cancer intrinsic subtypes Pathway-derived subtypes Clinical translation
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Groundwater hydrodynamics and supply sustainability in Punjab,Pakistan:A geological statistical approach using the GAMEAS algorithm based on data from 1105 boreholes
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作者 Muhammad Afzal Tie Liu +6 位作者 An-ming Bao Xi Chen Xiao-hui Pan Solange Uwamahoro Ahmad Mujta Adeel Ahmed Nadeem Asim Qayyum Butt 《China Geology》 2026年第1期44-59,共16页
Effective groundwater management is crucial for economic sustainable development,particularly as climate change and population growth increase the uncertainty of aquifer dynamics.Due to limited geological data,Punjab&... Effective groundwater management is crucial for economic sustainable development,particularly as climate change and population growth increase the uncertainty of aquifer dynamics.Due to limited geological data,Punjab's complex hydrogeological conditions and Quaternary alluvial deposits present significant challenges for groundwater management.This study employs cost-effective numerical techniques as alternatives to traditional methods to safeguard groundwater quality,quantity,and accessibility.It introduces an edit-embedded transition frequency model that integrates regional datasets and utilizes algorithms such as GAMEAS,MCMOD,and TSIM to evaluate aquifer heterogeneity and simulate spatial variations using one-dimensional and three-dimensional Markov chains.Findings show that sand exhibits the highest self-transition(33.112 m),indicating strong stability,followed by silt,clay,and gravel,suggesting overall hydrofacies stability both horizontally and vertically.The model's predictions are largely consistent with actual material distribution,with a slight under-prediction of clay(-0.750%)and an over-prediction of sand(2.985%),which accounts for 58.77%of the aquifer material.It also highlights significant heterogeneity in the northern mountainous regions and minor variations in the south.The study emphasizes Punjab's severe water crisis,with groundwater reserves of 3502.3 BCM,declining water levels(0.38–33.62 m),and low hydraulic conductivity,urging government action on rainwater harvesting and sustainable groundwater management policies. 展开更多
关键词 Groundwater management Economic sustainable development T-progs modelling Aquifer heterogeneity Groundwater sustainability Environment degradation Catchment recharging
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Strong yet ductile low-density steel via multiphase heterogeneous microstructure
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作者 Jiahe YAN Zhinan YANG +4 位作者 Jinliang DU Yunli FENG Minghe ZHANG Xiaoyong FENG Fucheng ZHANG 《Chinese Journal of Aeronautics》 2026年第1期656-673,共18页
Under equivalent stiffness conditions,material substitution based on a thin-walled design is crucial for the lightweight of components.Developing high-performance steels with both high-yield strength and excellent duc... Under equivalent stiffness conditions,material substitution based on a thin-walled design is crucial for the lightweight of components.Developing high-performance steels with both high-yield strength and excellent ductility has become a key focus in fields like aerospace and lowaltitude flight.The novel low-density steel presented here exhibits a yield strength of 1000 MPa,which is 2-3 times higher than conventional low-alloy high-strength steels,while maintaining an elongation of about 18.7%.By combining ex-situ experimental characterization with a phase mechanical response model based on the iso-work theory and the von Mises equivalent method,the role of heterogeneous deformation-induced strengthening was revealed.The calculated values align closely with experimental results.This exceptional performance is attributed to a multiphase heterogeneous microstructure,where fresh martensite,bainite/tempered martensite,and deformation-induced martensite act as hard regions.These regions release micro-stresses through inhomogeneous cooperative deformation with soft ferrite,enabling multiple plastic deformation mechanisms and stress concentration relief.This research offers new insights into optimizing microstructures through mechanical metallurgy,which is crucial for producing high-performance,lightweight components. 展开更多
关键词 Constitutive model Low-density steel Multiphase heterogeneous microstructure Strength and ductility Stress concentration relieving
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