机构

• 上海药物研究所 [5]
• 近代物理研究所 [5]
• 力学研究所 [3]
• 过程工程研究所 [3]
• 金属研究所 [2]
• 化学研究所 [2]
• 更多

采集方式

• OAI收割 [25]
• iSwitch采集 [1]

内容类型

• 期刊论文 [26]

发表日期

• 2024 [1]
• 2023 [1]
• 2022 [1]
• 2021 [1]
• 2020 [1]
• 2019 [2]
• 更多

学科主题

• Chemistry [2]
• 交叉与边缘领域的力学... [1]

筛选

浏览/检索结果: 共26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 Synthesis and evaluation of hybrid molecules as RIPK1 and HDACs dual inhibitors 期刊论文  OAI收割 JOURNAL OF MOLECULAR STRUCTURE, 2024, 卷号: 1318, 页码: 13 作者:  Tang, Mingze;  Zhou, Xuan;  Shen, Qianqian;  Fang, Chen;  Peng, Xia   |  收藏  |  浏览/下载：12/0  |  提交时间：2024/08/22 Receptor -interacting protein kinase 1  Histone deacetylases  Inhibitor  Molecular dynamics (MD) simulation  ADMET analysis   Water adsorption and diffusion in phosphoric acid-based geopolymer using molecular modeling 期刊论文  OAI收割 JOURNAL OF SOLID STATE CHEMISTRY, 2023, 卷号: 320, 期号: -, 页码: - 作者:  Hu, Haixiang;  Huang, Kangqiao;  Zhou, Wei;  Liu, Xinghong;  Chang, Xiaolin   |  收藏  |  浏览/下载：16/0  |  提交时间：2023/08/02 Phosphoric acid -based geopolymer (PABG)  Water adsorption and diffusion  Diffusion exponent  Macromolecular model  Molecular dynamics (MD) simulation   Molecular dynamics simulation of phosphoric acid-based geopolymer 期刊论文  OAI收割 JOURNAL OF SOLID STATE CHEMISTRY, 2022, 卷号: 312, 期号: -, 页码: - 作者:  Huang, Kangqiao;  Zhou, Wei;  Hu, Haixiang;  Liu, Xinghong;  Chang, Xiaolin   |  收藏  |  浏览/下载：16/0  |  提交时间：2023/08/02 Phosphoric acid-based geopolymer (PABG)  Molecular dynamics (MD) simulation  The modified Dreiding force field  The new macromolecular model  Structural and mechanical properties   Integration of Computational Toxicology, Toxicogenomics Data Mining, and Omics Techniques to Unveil Toxicity Pathways 期刊论文  OAI收割 ACS SUSTAINABLE CHEMISTRY & ENGINEERING, 2021, 卷号: 9, 期号: 11, 页码: 4130-4138 作者:  Wang, Xiaoqing;  Li, Fei;  Chen, Jingwen;  Ji, Chenglong;  Wu, Huifeng   |  收藏  |  浏览/下载：34/0  |  提交时间：2021/05/22 Adverse outcome pathway (AOP)  Comparative toxicogenomics database (CTD)  Triphenyl phosphate (TPP)  Molecular dynamics (MD)  Transcriptome analyses   Interactions between hydrogen bubbles and prismatic interstitial dislocation loops in BCC iron 期刊论文  OAI收割 COMPUTATIONAL MATERIALS SCIENCE, 2020, 卷号: 180, 页码: 8 作者:  Wei, Yaxia;  Gao, Ning;  Shen, Zhenyu;  Chen, Cheng;  Xie, Ziyang   |  收藏  |  浏览/下载：27/0  |  提交时间：2022/01/13 Pinning mechanism  Hydrogen bubble  Dislocation loop  Molecular dynamics (MD)   Effect of hydrogen atom concentration on hydrogen migration and bubble evolution in bcc iron 期刊论文  OAI收割 NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2019, 卷号: 461, 页码: 83-87 作者:  Wei, Y. X.;  Gao, N.;  Wang, D.;  Chen, C.;  Guo, L. P.   |  收藏  |  浏览/下载：27/0  |  提交时间：2022/01/19 Hydrogen  High concentration  Diffusion  Molecular dynamics (MD)   Anticorrosion and lubricating properties of a fully green lubricant 期刊论文  OAI收割 Tribology Inernational, 2019, 期号: 130, 页码: 324-333 作者:  Dongdong Zheng;  Xiaobo Wang;  Ming Zhang;  Zhongguo Liu;  Chao Ju   |  收藏  |  浏览/下载：49/0  |  提交时间：2018/11/27 Ricinoleic Acid Based Ionic Liquid  Anticorrosion  Lubricating Properties  Molecular Dynamics (Md) Simulations   Study on mechanical properties of polyethylene with chain branching in atomic scale by molecular dynamics simulation 期刊论文  OAI收割 MOLECULAR SIMULATION, 2018, 卷号: 44, 期号: 12, 页码: 1016-1024 作者:  Liao LJ(廖丽涓);  Meng CY(孟昶宇);  Huang CG(黄晨光) 收藏  |  浏览/下载：30/0  |  提交时间：2018/07/17 Chain Branching  Polyethylene (Pe)  Mechanical Properties  Molecular Dynamics (Md) Simulation  Atomic Scale   Effects of applied strain on nanoscale self-interstitial cluster formation in BCC iron 期刊论文  OAI收割 JOURNAL OF NUCLEAR MATERIALS, 2017, 卷号: 493, 页码: 62-68 作者:  Gao, Ning;  Wang, Zhiguang;  Kurtz, Richard J.;  Setyawan, Wahyu   |  收藏  |  浏览/下载：33/0  |  提交时间：2018/07/16 Self-interstitial nanocluster  Strain effect  Anisotropy distribution factor  Dislocation loop  Molecular dynamics (MD)   Evolution of nanoscale interstitial dislocation loops under coupling effect of stress and temperature 期刊论文  OAI收割 SCRIPTA MATERIALIA, 2017, 卷号: 136, 页码: 64-67 作者:  Gao, Ning;  Shen, Tielong;  Kurtz, Richard;  Wang, Zhiguang;  Gao, Fei   |  收藏  |  浏览/下载：13/0  |  提交时间：2018/05/31 Dislocation loop  Coupling effect  Decomposition  Non-conservation of burgers vector  Molecular dynamics (MD)