Study on Ultraviolet Aging Performance of Composite Modified Asphalt Based on Rheological Properties and Molecular Dynamics Simulation by Mingxing Gao, Conghao Fan, Xinxin Chen, Meijian Li

“…In order to study the effect of UV aging on asphalt performance, the asphalt four-component test, dynamic shear rheology test, and flexural creep stiffness test were combined with molecular dynamics simulation to matrix asphalt and rubber powder/styrene-butadiene rubber/polymerization. …”
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Generation of Rational Drug-like Molecular Structures Through a Multiple-Objective Reinforcement Learning Framework by Xiangying Zhang, Haotian Gao, Yifei Qi, Yan Li, Renxiao Wang

Subjects: “…molecular generative model…”
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Levetiracetam Ameliorates L-DOPA-Induced Dyskinesia in Hemiparkinsonian Rats Inducing Critical Molecular Changes in the Striatum by Huan Du, Shuke Nie, Guiqin Chen, Kai Ma, Yan Xu, Zhentao Zhang, Stella M. Papa, Xuebing Cao

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Prediction of influence of helical structure on shape memory behavior of thermosetting resin useing molecular dynamics simulation by Shuaijiang Ma, Qi Zhang, Xuyan Li, Jilei Xu, Ping Chen

Subjects: “…Molecular dynamic…”
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Toward thin GaSb Buffer Layers Grown on On‐Axis (001) Silicon by Molecular Beam Epitaxy by A. Gilbert, M. Ramonda, G. Patriarche, E. Tournié, J.‐B. Rodriguez

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Lanthanum Influence on EuAlO3 Perovskite Structural Properties: Experimental and Molecular Dynamics Studies by Enrique Lima, María Elena Villafuerte-Castrejón, José Saniger, Victor Lara, Jorge E. Sánchez-Sánchez, Luis Javier Álvarez

“…X-ray diffraction, 27Al MAS NMR, and FTIR spectra along with results of molecular dynamics simulations were used to characterise LaxEu1−xAlO3 perovskites for x=0.3,  0.1. …”
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Synthesis, Biological Activity, and Molecular Modeling Studies of Pyrazole and Triazole Derivatives as Selective COX-2 Inhibitors by Mohyeddin Assali, Murad Abualhasan, Hadeel Sawaftah, Mohammed Hawash, Ahmed Mousa

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Molecular Epidemiological Characteristics of blaIMP-4-Carrying Klebsiella pneumoniae ST-11 in Hospitalized Patients by Xue YE, Zhang D, Du S, Chen D, Liu S, Peng T, Li C, Zhang J, Wang X

“…Yu e Xue,1,* Dongmei Zhang,1,* Shuaixian Du,2,* Du Chen,3,* Shihan Liu,2 Tianfeng Peng,4 Chong Li,5 Jianchu Zhang,1 Xiaorong Wang1 1Department of Respiratory and Critical Care Medicine, Union Hospital, Tongji Medical College, Huazhong University of Science and Technology, Wuhan, Hubei, People’s Republic of China; 2Department of Clinical Laboratory, Union Hospital, Tongji Medical College, Huazhong University of Science and Technology, Wuhan, Hubei, People’s Republic of China; 3Department of Neurology, Guangzhou University of Chinese Medicine, Guangzhou, Guangdong, People’s Republic of China; 4Emergency Department, Union Hospital, Tongji Medical College, Huazhong University of Science and Technology, Wuhan, Hubei, People’s Republic of China; 5Gastrointestinal Surgery, Union Hospital, Tongji Medical College, Huazhong University of Science and Technology, Wuhan, Hubei, People’s Republic of China*These authors contributed equally to this workCorrespondence: Xiaorong Wang; Jianchu Zhang, Department of Respiratory and Critical Care Medicine, Union Hospital, Tongji Medical College, Huazhong University of Science and Technology, Number 1277, Jie Fang Rode, Wuhan, Hubei, 430022, People’s Republic of China, Tel + 86-27-85726707, Email rong-100@163.com; zsn0928@163.comPurpose: To investigate the molecular epidemiology and risk factors of carbapenem-resistant Klebsiella pneumoniae (CRKP) infection.Patients and Methods: Patient’s clinical data and CRKP strains were collected from November 2017 to December 2018 at a tertiary hospital in Wuhan, China. …”
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MORPHOLOGICAL AND MOLECULAR EVALUATION OF THE FAR EAST FRUIT GENETIC RESOURCES OF <i> LONICERA CAERULEA </i> L. by V. Holubec, T. N. Smekalova, L. Leisova-Svobodova

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Molecular genetic characteristics of broccoli (Brassica oleracea L. var. italica Plenck) from the VIR collection by D. A. Fateev, A. M. Artemyeva

“…In this regard, it seems relevant to evaluate the VIR collection of broccoli using molecular genetic markers, which will provide new source material for breeding.Materials and methods. …”
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Unveiling the toxicity of JWH-018 and JWH-019: Insights from behavioral and molecular studies in vivo and vitro by Fenghua Zhou, Yan Shi, Sujun Tan, Xiaoli Wang, Weicheng Yuan, Shuqi Tao, Ping Xiang, Bin Cong, Chunling Ma, Di Wen

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Molecular Detection and Multidrug Resistance of Shigella spp. Isolated from Wild Waterfowl and Migratory Birds in Bangladesh by Jarna Karmoker, Md. Saiful Islam, Md. Liton Rana, Md. Ashek Ullah, Fahim Haque Neloy, Nahian Muniath Oishy, Pritom Kumar Pramanik, Mahbubul Pratik Siddique, Sukumar Saha, Md. Tanvir Rahman

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Calculation of ternary Si-Fe-Al phase equilibrium in vacuum distillation by molecular interaction volume model by Liu K., Wu J.J., Ma W.H., Yang B., Yang X., Kong L.X., Zeng X.F., Dai Y.N.

Subjects: “…molecular interaction volume model…”
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Molecular genetic factors influencing outcomes of <i>Helicobacter pylori</i> infection at Khakasia republic inhabitants by Ye. S. Ageyeva, O. V. Shtygasheva, N. V. Ryazantseva, V. V. Tsukanov

“…Aim of investigation. To detect molecular-genetic features of Helicobacter pylori and polymorphism of main immunoregulatory interleukins genes at Khakases, to estimate their effect on outcomes of infection pathogen.Material and methods. …”
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Temperature-induced flexibility of graphene sheet facilitates RNA duplex unzipping: A molecular dynamics study by Maksym V. Karachevtsev, Victor A. Karachevtsev

“…As an example of tunable and inducible flexibility of a graphene sheet, we used temperature-dependent flexibility of graphene sheet in our simulation. Molecular dynamics simulations demonstrated that duplex (rA)15:(rU)15 adsorbed on the flexible graphene sheet in a water environment unzipped at room temperature much faster than on graphene with fixed carbon atoms. …”
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Molecularly imprinted polypyrrole-modified screen-printed electrode: Toward a sensor for furfural derivatives determination by Daniele Merli, Alessandra Cutaia, Sofia Prosperi, Camilla Zanoni, Giancarla Alberti

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Immunohistochemistry‐based molecular subtypes of urothelial carcinoma derive different survival benefit from platinum chemotherapy by Csilla Olah, Oleksandr Shmorhun, Gilbert Georg Klamminger, Josefine Rawitzer, Lara Sichward, Boris Hadaschik, Mulham Al‐Nader, Ulrich Krafft, Christian Niedworok, Melinda Váradi, Peter Nyirady, Andras Kiss, Eszter Szekely, Henning Reis, Tibor Szarvas

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Exploring the Interactions Between Caffeic Acid and Human Serum Albumin Using Spectroscopic and Molecular Docking Techniques by Ali Jahanban-Esfahlan, Leila Roufegarinejad, Mahnaz Tabibiazar, José M. Lorenzo, Ryszard Amarowicz

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The molecular dynamics study of the thermal behavior of argon flow in a nanochannel with changes in nanochannel cross-section by Reza Karimi, Ali Marzban, Davood Toghraie

Subjects: “…Molecular dynamics…”
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Adsorption Behaviour of Normal Paraffins in a Fixed Bed Adsorber Containing 5 Å Molecular Sieves by Liu Jichang, Shen Benxian, Sun Hui

“…The adsorption process for separating normal paraffins from naphtha using 5 Å molecular sieves was studied with the purpose of optimizing the utilization of naphtha and providing a proper allocation of the feeds for the steam cracking and catalytic reforming processes. …”
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