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Conformation of an Amphiphilic Comb-like Copolymer in a Selective Solvent

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Chinese Journal of Polymer Science 2023年第9期41卷 1386-1391,I0006页

作者： Peng Hao Xing-Hong Mai Qiao-Yue Chen ming-ming ding Xinjiang Laboratory of Phase Transitions and Microstructures in Condensed Matter Physics College of Physical Science and TechnologyYili Normal UniversityYining835000China School of Chemical Engineering and Light Industry Guangdong University of TechnologyGuangzhou510006China

We study the conformation of an amphiphilic comb-like copolymer in a selective solvent by using Brownian dynamics *** results demonstrate that,there is an optimal total degree of polymerization to form spherical *** when the total degree of polymerization is less than the optimal total degree of polymerization,a unimolecular spherical micelle can be formed,otherwise,the spherical micelle will be transformed into a cylindrical *** the total degree of polymerization is less than the optimal total degree of polymerization,the radius of gyration and the stretching factor meet an exponential relationship,where the power exponent decreases with the increase of the length of hydrophilic side *** fundamental principles uncovered here afford insights for the optimization of molecular design of amphiphilic comb-like copolymers in various applications.

关键词： Comb-like copolymer Conformation Selective solvent Brownian dynamics

Statistics of Polymer Capture by a Nanopore:A Brownian Dynamics Simulation Study

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Chinese Journal of Polymer Science 2015年第5期33卷 674-679页

作者： ming-ming ding Xiao-zheng Duan 卢宇源石彤非 State Key Laboratory of Polymer Physics and Chemistry Changchun Institute of Applied ChemistryChinese Academy of Sciences

We investigate the statistics of polymer capture by a nanopore using Brownian dynamics simulations. It is found that when the velocity flux is greater than a critical velocity flux, the capture picture is a random selection process, otherwise it tends to a statistical process governed by energetic considerations. In addition, the chain ends capture probability decreases as the chain length increases and satisfies a power-law scaling of P0（N）-N^-0.8.

关键词： Polymer capture Critical velocity flux Brownian dynamics

Self-assembled Conformations of a Core-shell Comb-like Chain with Adjustable Architectural Parameters

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Chinese Journal of Polymer Science 2023年第9期41卷 1439-1446,I0008页

作者： Huan-Li Qi Heng-Wei Zhou Chao Duan Wei-Hua Li ming-ming ding Xinjiang Laboratory of Phase Transitions and Microstructures in Condensed Matter Physics College of Physical Science and TechnologyYili Normal UniversityYining835000China State Key Laboratory of Molecular Engineering of Polymers Department of Macromolecular ScienceFudan UniversityShanghai200433China School of Chemical Engineering and Light Industry Guangdong University of TechnologyGuangzhou510006China

Combining Brownian dynamics simulations and self-consistent field theory,we demonstrate that the architectural parameters of coreshell comb-like chains have a decisive influence on their final self-assembled *** the ratio of hydrophilic and hydrophobic segments is N_(g,g)∶N_(g,r)=3∶1,no core-shell structure is observed,and unsegregated chains or clusters are *** N_(g,g)∶N_(g,r)=3∶2or 3∶3,the core-shell comb-like chains can be assembled into single micelles or structures where several small micelles are strung together by the backbone,which is similar to the pearl-necklace structure formed by the polyelectrolytes in poor *** the increase of backbone length or grafting density,the probability of forming single micelles becomes lower,but the structures of two,three or more small micelles strung together are more *** results indicate how to obtain the desired self-assembled structures of core-shell comb-like chains by regulating the architectural parameters,which could provide insights for the optimization of molecular design in various applications.

关键词： Comb-like polymer Self-assembled conformations Brownian dynamics simulations

Fast Computation of Electrostatic Interactions for a Charged Polymer with Applied Field

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Chinese Journal of Polymer Science 2020年第6期38卷 665-672页

作者： Hao Lin Zi-Tong Lei ming-ming ding Hong-Jun Wang Tong-Fei Shi School of Mathematics Jilin Normal UniversityChangchun 130103China State Key Laboratory of Polymer Physics and Chemistry Changchun Institute of Applied ChemistryChinese Academy of SciencesChangchun 730022China College of Computer Jilin Normal UniversitySi ping 136000China School of Applied Chemistry and Engineering University of Science and Technology of ChinaHefei230026China

Using a hybrid simulation approach that combines a finite difference method with a Brownian dynamics,we investigated the motion of charged *** to the fact that polymer-solution systems often contain a large number of particles and the charged palymer chains are in a state of random motion,it is a time consuming task to calculate the electrostatic interaction of the ***,we propose a new strategy to shorten the CPU time by reducing the iteration *** simulation results ilustrate the effect of preset parameters on CPU time and accuracy,and demonstrate the feasibility of the"local iteration"***,we find that the increase in the number of charged beads has no signifiant infuence on the time of global iterations and local *** a number of 80×80×80 grids,when the relative error is controlled below 1.5%,the computational efficiency is increased by 8.7 times in the case that contains 500 charged *** adition,for a number of 100×100×100 grids with 100 charged beads,the computational efciency can be increased up to 12 *** work provides new insights for the optimization of iterative algorithms in special problems.

关键词： Finite dfference method Brownian dynamics Charged polymers Electrostatic interaction Local iteration

A new guaianolide from the roots of Pterocypsela elata

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Chinese Chemical Letters 2013年第1期24卷 55-56页

作者： Yi-Xiao Bai Jing Tan Fu-Lin Yan ming-ming ding Xiang Wang Pharmacy College Xinxiang Medical University Third Clinical College of Xinxiang Medical University

In order to find more biologically active substances, we have carefully investigated the chemical constituents of Pterocypsela elata. One new guaianolide, （4S）-ll-methoxycarbonyl-guaiane- l（10）,5（6）,7（11）,8（9）-tetraen-6,12-olide was isolated from the EtOAc extracts of the roots of P. elata. Its structure was elucidated by various spectroscopic methods and confirmed by X-ray crystallographic analysis.

关键词： CompositaePterocypsela elataSesquiterpene lactonesGuaianolide

Effect of Trastuzumab on the Micellization Properties, Endocytic Pathways and Antitumor Activities of Polyurethane-based Drug Delivery System

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Chinese Journal of Polymer Science 2017年第8期35卷 909-909,910-923页

作者： Ni-jia Song Li-juan Zhou Wen-kai Liu Xue-ling He Zhi-cheng Pan ming-ming ding Xin-yuan Wan 李洁华谭鸿 Feng Luo Qiang Fu College of Polymer Science and Engineering State Key Laboratory of Polymer Materials EngineeringSichuan University Key Laboratory of Rubber-Plastics Ministry of Education/Shandong Provincial Key Laboratory of Rubber-PlasticsQingdao University of Science & Technology Laboratory Animal Center of Sichuan University Huaxi Clinical CollegeSichuan University

Polyurethane micelles（PM）-based nanovehicles have shown great potential in targeted delivery of therapeutics and diagnostics into ***,the pathways of PMs entering cancer cells and the action mechanism of targeting ligands have yet to be *** this contribution,the actively-targeted PM were developed using trastuzumab as a model targeting *** was found that PM were mainly taken up by SKOV-3 tumor cells via a micropinocytosis process,while the incorporation of trastuzumab to PM enabled a receptor-mediated endocytosis of nanocarriers in cancer cells,leading to more efficient cell entry and enhanced anticancer efficacy of chemotherapeutic drugs both in vitro and in *** study is advantageous to the understanding of the action mechanism of trastuzumab,and significant for the construction of improved formulations for targeted delivery and precise therapy.

关键词： targeting targeted micelle understood diagnostics advantageous loaded anticancer conjugated incorporation

Hybrid Network Model Based on Data Enhancement for Short-term Power Prediction of New PV Plants

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Journal of Modern Power Systems and Clean Energy 2024年第1期12卷 77-88页

作者： Shangpeng Zhong Xiaoming Wang Bin Xu Hongbin Wu ming ding the Anhui Province Key Laboratory of Renewable Energy Utilization and Energy Saving Hefei University of TechnologyHefei 230009China the State Grid Anhui Electric Power Research Institute Hefei 230061China

This study proposes a hybrid network model based on data enhancement to address the problem of low accuracy in photovoltaic(PV)power prediction that arises due to insuffi cient data samples for new PV ***,a time-series gener ative adversarial network(TimeGAN)is used to learn the distri bution law of the original PV data samples and the temporal correlations between their features,and these are then used to generate new samples to enhance the training ***,a hybrid network model that fuses bi-directional long-short term memory(BiLSTM)network with attention mechanism(AM)in the framework of deep&cross network(DCN)is con structed to effectively extract deep information from the origi nal features while enhancing the impact of important informa tion on the prediction ***,the hyperparameters in the hybrid network model are optimized using the whale optimi zation algorithm(WOA),which prevents the network model from falling into a local optimum and gives the best prediction *** simulation results show that after data enhance ment by TimeGAN,the hybrid prediction model proposed in this paper can effectively improve the accuracy of short-term PV power prediction and has wide applicability.

关键词： New photovoltaic(PV)plant short-term predic tion time-series generative adversarial network(TimeGAN) hy brid network hyperparameter

Communication Resource-Efficient Vehicle Platooning Control With Various Spacing Policies

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IEEE/CAA Journal of Automatica Sinica 2024年第2期11卷 362-376页

作者： Xiaohua Ge Qing-Long Han Xian-ming Zhang Derui ding IEEE School of Science Computing and Engineering TechnologiesSwinburne University of TechnologyMelbourne VIC 3122Australia

Platooning represents one of the key features that connected automated vehicles may possess as it allows multiple automated vehicles to be maneuvered cooperatively with small headways on roads. However, a critical challenge in accomplishing automated vehicle platoons is to deal with the effects of intermittent and sporadic vehicle-to-vehicle data transmissions caused by limited wireless communication resources. This paper addresses the co-design problem of dynamic event-triggered communication scheduling and cooperative adaptive cruise control for a convoy of automated vehicles with diverse spacing policies. The central aim is to achieve automated vehicle platooning under various gap references with desired platoon stability and spacing performance requirements, while simultaneously improving communication efficiency. Toward this aim, a dynamic event-triggered scheduling mechanism is developed such that the intervehicle data transmissions are scheduled dynamically and efficiently over time. Then, a tractable co-design criterion on the existence of both the admissible event-driven cooperative adaptive cruise control law and the desired scheduling mechanism is derived. Finally, comparative simulation results are presented to substantiate the effectiveness and merits of the obtained results.

关键词： Automated vehicles constant time headway spacing constant spacing cooperative adaptive cruise control event-triggered communication vehicle platooning

Planning of DC Electric Spring with Particle Swarm Optimization and Elitist Non-dominated Sorting Genetic Algorithm

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CSEE Journal of Power and Energy Systems 2024年第2期10卷 574-583页

作者： Qingsong Wang Siwei Li Hao ding ming Cheng Giuseppe Buja School of Electrical Engineering and Jiangsu Provincial Key Laboratory of Smart Grid Technology and Equipment Southeast UniversityNanjing 210096China School of Software Engineering Southeast universitySuzhou 215123China

This paper addresses the planning problem of parallel DC electric springs (DCESs). DCES, a demand-side management method, realizes automatic matching of power consumption and power generation by adjusting non-critical load (NCL) and internal storage. It can offer higher power quality to critical load (CL), reduce power imbalance and relieve pressure on energy storage systems (RESs). In this paper, a planning method for parallel DCESs is proposed to maximize stability gain, economic benefits, and penetration of RESs. The planning model is a master optimization with sub-optimization to highlight the priority of objectives. Master optimization is used to improve stability of the network, and sub-optimization aims to improve economic benefit and allowable penetration of RESs. This issue is a multivariable nonlinear mixed integer problem, requiring huge calculations by using common solvers. Therefore, particle Swarm optimization (PSO) and Elitist non-dominated sorting genetic algorithm (NSGA-II) were used to solve this model. Considering uncertainty of RESs, this paper verifies effectiveness of the proposed planning method on IEEE 33-bus system based on deterministic scenarios obtained by scenario analysis.

关键词： DC distribution network DC electric spring non-dominated sorting genetic algorithm particle swarm optimization renewable energy source