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A novel two-dimensional monolayer tetragonal boron carbide as a promising anode for Mg-ion
作者Qamar Abuhassan; Ghada Al-Assi; Muthanna K. Kareem; Chethan M; D. Jumanazarove; Tapas Kumar Mohapatra; Parasuraman K; Sanjeev Kumar; Abdusalom Umarov; Bakhodir Saydullaev; Miyribek Seytnazarov
作者单位1. Department of Pharmaceutics and Pharmaceutical Technology, School of Pharmacy, University of Jordan, Amman, Jordan; 2. Faculty of Allied Medical Sciences, Hourani Center for Applied Scientific Research, Al-Ahliyya Amman University, Amman, Jordan; 3. College of Engineering, Al-Ayen University, Thi-Qar, Iraq; 4. Department of Physics & Electronics, School of Sciences, JAIN (Deemed to Be University), Bangalore, India; 5. Medical Laboratory Technique College, The Islamic University, Najaf, Iraq; 6. Department of Electrical Engineering, Siksha ‘O’ Anusandhan (Deemed to Be University), Bhubaneswar, India; 7. Department of Physics, Sathyabama Institute of Science and Technology, Chennai, India; 8. Department of Physics, University Institute of Sciences, Chandigarh University, Mohali, India; 9. University of Tashkent for Applied Sciences, Tashkent, Uzbekistan; 10. The Department of Pharmaceutical and Chemistry, Alfraganus University, Tashkent, Uzbekistan; 11. Kimyo International University in Tashkent, Tashkent, Uzbekistan
Beyond single-structure docking in anti-Zika discovery: toward translational molecular modeling
作者Rajesh Prasad Jayaswal; Deen Dayal; Kundan Kumar Chaubey
作者单位1. Department of Medical Laboratory Science, University Institute of Allied Health Sciences, Chandigarh University, Mohali, India; 2. Department of Biotechnology, GLA University, Mathura, India; 3. School of Basic and Applied Sciences, Sanskriti University, Mathura, India
Covalent phosphorylation of poly(vinyl alcohol) eliminates phosphoric acid leaching without reducing proton donor activity: a short communication
作者Shahid Ali; Aqleema Aslam; Ugwuanyi Uchenna Victor; Batool Alkhateeb; Thiru Kumaran Ponnusamy Malar; Basit Ali; Zeesham Ali
作者单位1. National University of Science and Technology MISIS (NUST MISIS), Moscow, Russia; 2. Yanshan University, Qinhuangdao, China; 3. Beijing Institute of Technology, Beijing, China
Effects of Zn doping on the mechanical and thermoelectric properties of calcium silicate hydrate
作者Jiaxin Wang; Guili Liu; Lin Wei
作者单位1. Shenyang University of Technology, Liaoning, People’s Republic of China; 2. University of Science and Technology Liaoning, Lishan District, Liaoning, People’s Republic of China
Electronic structure modeling of transition metal hyperdoping in β -Ga 2 O 3 : concentration-dependent band hybridization and optoelectronic tuning
作者Jingjie Yuan; Wen Wang; Tingting Wang; Yun Li; Qingyun Yang; Mingyang Tian; Ling Li; Ke Liu; Mao Wang
作者单位1. Key Laboratory of Micro-Nano Optoelectronic Materials and Devices at, Sichuan Normal University of Sichuan Province, Chengdu, China; 2. College of Physics and Electronic Engineering, Sichuan Normal University, Chengdu, China; 3. Key Laboratory for Microelectronics, College of Physics, Sichuan University, Chengdu, China
Electronic effects on the stability of heteroleptic nickel(II) complexes with aromatic and aliphatic ligands
作者Daniella B. de Miranda; Thalita R. André; Glaucio B. Ferreira
作者单位1. Instituto de Química, Universidade Federal Fluminense, Outeiro de S. João Batista S/N, Centro, Niterói, Brazil
Identification of potential inhibitors of dengue virus ns5 methyltransferase and polymerase domains through virtual screening and molecular dynamics studies
作者Nabeel Haider; Abolfazl Zare; Yi Zhou; Faez Iqbal Khan
作者单位1. College of Bioscience and Biotechnology, Yangzhou University, Yangzhou Jiangsu Province, China; 2. Department of Biology, Yazd University, Yazd, Iran; 3. Department of Biosciences and Bioinformatics, School of Science, Xi’an Jiaotong-Liverpool University, Suzhou, China
Mechanisms of the binding of camptothecin derivatives with topoisomerase I: Molecular docking, molecular dynamics simulations, and binding free energy calculations
作者Jingli Liu; Jingyu Qu; Yingying Xue; Yajun Shi; Mingsong Shi
作者单位1. College of Pharmacy, Shaanxi University of Chinese Medicine, Xianyang, People’s Republic of China; 2. National Health Commission Key Laboratory of Nuclear Technology Medical Transformation, School of Medicine, Mianyang Central Hospital, University of Electronic Science and Technology of China, Mianyang, People’s Republic of China
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