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浏览/检索结果: 共156条，第1-10条 帮助 条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择题名升序题名降序提交时间升序提交时间降序作者升序作者降序发表日期升序发表日期降序 Description of Short-Range Interactions of Carbon-Based Materials with a Combined AIREBO and ZBL Potential 期刊论文  OAI收割 NANOMATERIALS, 2024, 卷号: 14, 期号: 17, 页码: 15 作者:  Li, Jing;  Shi, Tan;  Sun, Yichao;  Cai, Xintian;  Gao, Rui   |  收藏  |  浏览/下载：5/0  |  提交时间：2024/10/14 ion irradiation  irradiation damage  carbon  graphene  molecular dynamics   Platanosides from Platanus x acerifolia: New molecules, SAR, and target validation of a strong lead for drug-resistant bacterial infections and the associated sepsis 期刊论文  OAI收割 BIOORGANIC CHEMISTRY, 2024, 卷号: 143, 页码: 9 作者:  Wu, Xi-Ying;  Zhao, Ze-Yu;  Osman, Ezzat E. A.;  Wang, Xiao-Juan;  Choo, Yeun-Mun   |  收藏  |  浏览/下载：38/0  |  提交时间：2024/03/06 Platanus x acerifolia  Platanosides  Molecular ion networking (MoIN)  Antibacterial  Staphylococcus aureus  Enterococcus faecium  Structure -activity relationship (SAR)  Molecular docking  Target validation   Linking the source, molecular composition, and reactivity of dissolved organic matter in major rivers across the pearl river delta 期刊论文  OAI收割 JOURNAL OF CLEANER PRODUCTION, 2023, 卷号: 420, 页码: 10 作者:  Huang, Lu;  Wang, Wencai;  Wei, Gangjian;  Li, Shida;  Yang, Mengdi   |  收藏  |  浏览/下载：8/0  |  提交时间：2024/09/10 Dissolved organic matter  Molecular composition  Fourier transform ion cyclotron resonance mass  spectrometry  Degradation kinetics  Anthropogenic perturbation   Revealing the wetting mechanism of Li plus -doped ionic liquids on the TiO2 surface 期刊论文  OAI收割 CHEMICAL ENGINEERING SCIENCE, 2023, 卷号: 265, 页码: 9 作者:  Wang, Chenlu;  Liu, Guangyong;  Cao, Renqiang;  Xia, Yu;  Wang, Yanlei   |  收藏  |  浏览/下载：33/0  |  提交时间：2023/02/24 Ionic liquids  Lithium-ion  Electrode interface  Molecular dynamics simulation  Energy storage   Regulating the concentration of dissolved oxygen to achieve the directional transformation of reactive oxygen species: A controllable oxidation process for ciprofloxacin degradation by calcined CuCoFe-LDH 期刊论文  OAI收割 WATER RESEARCH, 2023, 卷号: 233, 页码: 119744 作者:  Wang, Shaohong;  Li, Ting;  Cheng, Xiang;  Zhu, Runliang;  Xu, Yin   |  收藏  |  浏览/下载：8/0  |  提交时间：2024/09/26 MOLECULAR-OXYGEN  SUPEROXIDE ION  GENERATION  ACTIVATION   Mass spectrometry imaging: new eyes on natural products for drug research and development 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2022, 页码: 16 作者:  Hou, Jin-jun;  Zhang, Zi-jia;  Wu, Wen-yong;  He, Qing-qing;  Zhang, Teng-qian   |  收藏  |  浏览/下载：42/0  |  提交时间：2022/11/11 natural product  mass spectrometry imaging  MALDI  DESI  molecular imaging  ion mobility   Atomic-Scale Design of Anode Materials for Alkali Metal (Li/Na/K)-Ion Batteries: Progress and Perspectives 期刊论文  OAI收割 ADVANCED ENERGY MATERIALS, 2022, 页码: 29 作者:  Olsson, Emilia;  Yu, Jiale;  Zhang, Haiyan;  Cheng, Hui-Ming;  Cai, Qiong   |  收藏  |  浏览/下载：41/0  |  提交时间：2022/07/14 anodes  density functional theory  lithium-ion batteries  materials design  molecular dynamics  potassium-ion batteries  sodium-ion batteries   Molecular dynamics simulation of the interfacial wetting behavior of brine/ sandstone with different salinities 期刊论文  OAI收割 COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 2022, 卷号: 632, 页码: 10 作者:  Yu, Tao;  Li, Qi;  Hu, Haixiang;  Tan, Yongshen;  Xu, Liang   |  收藏  |  浏览/下载：66/0  |  提交时间：2022/01/05 Molecular dynamics simulation  Wettability  Salinity  Hydration  Ion association   Folding Dynamics of 3,4,3-LI(1,2-HOPO) in Its Free and Bound State with U4+ Implicated by MD Simulations 期刊论文  OAI收割 MOLECULES, 2022, 卷号: 27, 期号: 23, 页码: 8151 作者:  Wang, Q;  Liu, ZY;  Song, YF;  Wang, DQ   |  收藏  |  浏览/下载：11/0  |  提交时间：2023/11/10 3  4  3-LI(1  2-HOPO)  molecular dynamics  decorporation  actinides  tetravalent uranium ion   Computational Auxiliary for the Progress of Sodium-Ion Solid-State Electrolytes 期刊论文  OAI收割 ACS NANO, 2021, 卷号: 15 作者:  Yang, Kaishuai;  Liu, Dayong;  Qian, Zhengfang;  Jiang, Dongting;  Wang, Renheng   |  收藏  |  浏览/下载：39/0  |  提交时间：2022/03/21 sodium-ion solid-state electrolytes  all-solid-state sodium batteries  computational auxiliary  ab initio calculations  molecular dynamics simulations  nanoscale insight  ion transport mechanisms  sodium-ion conductor