机构

• 上海药物研究所 [17]

采集方式

• OAI收割 [17]

内容类型

• 期刊论文 [17]

发表日期

• 2023 [1]
• 2020 [3]
• 2017 [1]
• 2016 [2]
• 2015 [1]
• 2013 [3]
• 更多

学科主题

筛选

浏览/检索结果: 共17条，第1-10条 帮助 限定条件 专题：上海药物研究所    第一署名单位    第一作者单位    通讯作者单位     条数/页： 5101520253035404550556065707580859095100 排序方式： 请选择提交时间升序提交时间降序题名升序题名降序作者升序作者降序发表日期升序发表日期降序 Focused Nanosecond Pulsed Laser-Induced Homogeneous Nucleation in Undercooled Oxide Melts 期刊论文  OAI收割 ADVANCED ENGINEERING MATERIALS, 2023, 页码: 7 作者:  Zhong, Qiu;  Li, Huidong;  Tao, Ye;  Cao, Chengcheng;  Yang, Liping   |  收藏  |  浏览/下载：18/0  |  提交时间：2023/10/17 crystallization  induced nucleation  melt  pulsed laser  undercooled   Quantum Mechanical-NMR-Aided Configuration and Conformation of Two Unreported Macrocycles Isolated from the Soft Coral Lobophytum sp.: Energy Calculations versus Coupling Constants 期刊论文  OAI收割 ORGANIC LETTERS, 2020, 卷号: 22, 期号: 11, 页码: 4093-4096 作者:  Li, Song-Wei;  Cuadrado, Cristina;  Yao, Li-Gong;  Daranas, Antonio Hernandez;  Guo, Yue-Wei   |  收藏  |  浏览/下载：19/0  |  提交时间：2020/12/24 Accurate prediction of relative binding affinities of a series of HIV-1 protease inhibitors using semi-empirical quantum mechanical charge 期刊论文  OAI收割 JOURNAL OF COMPUTATIONAL CHEMISTRY, 2020, 页码: 8 作者:  Peng, Cheng;  Wang, Jinan;  Xu, Zhijian;  Cai, Tingting;  Zhu, Weiliang   |  收藏  |  浏览/下载：14/0  |  提交时间：2020/07/01 adaptive steered molecular dynamics (ASMD)  binding affinity  HIV-1 protease  semi-empirical quantum mechanics   Nanomechanical characterization of pressurized elastic fluid nanovesicles using indentation analysis 期刊论文  OAI收割 EXTREME MECHANICS LETTERS, 2020, 卷号: 34, 页码: 9 作者:  Tang, Xingyi;  Shi, Xinghua;  Gan, Yong;  Yi, Xin   |  收藏  |  浏览/下载：76/0  |  提交时间：2020/07/01 Indentation  Nanovesicles  Osmotic pressure  Young's modulus  Stiffness   Dynamical heterogeneities and mechanical non-linearities: Modeling the onset of plasticity in polymer in the glass transition 期刊论文  OAI收割 The European physical journal. E, Soft matter, 2017, 卷号: 40, 期号: 12, 页码: 116 作者:  Masurel, R J;  Gelineau, P;  Lequeux, F;  Cantournet, S;  Montes, H   |  收藏  |  浏览/下载：16/0  |  提交时间：2019/01/08 A computational investigation on the substrate preference of ten-eleven-translocation 2 (TET2) 期刊论文  OAI收割 PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2016, 卷号: 18, 期号: 6, 页码: 4728-4738 作者:  Lu, Junyan;  Hu, Lulu;  Cheng, Jingdong;  Fang, Dong;  Wang, Chen   |  收藏  |  浏览/下载：25/0  |  提交时间：2019/01/08 Stability and Characteristics of the Halogen Bonding Interaction in an Anion-Anion Complex: A Computational Chemistry Study 期刊论文  OAI收割 JOURNAL OF PHYSICAL CHEMISTRY B, 2016, 卷号: 120, 期号: 4, 页码: 610-620 作者:  Wang, Guimin;  Chen, Zhaoqiang;  Xu, Zhijian;  Wang, Jinan;  Yang, Yang   |  收藏  |  浏览/下载：13/0  |  提交时间：2019/01/08 Structure investigation of nanohybrid PDMA/silica hydrogels at rest and under uniaxial deformation 期刊论文  OAI收割 Soft matter, 2015, 卷号: 11, 期号: 29, 页码: 5905-17 作者:  Rose, Séverine;  Marcellan, Alba;  Narita, Tetsuharu;  Boué, François;  Cousin, Fabrice   |  收藏  |  浏览/下载：13/0  |  提交时间：2019/01/08 Energetic factors determining the binding of type I inhibitors to c-Met kinase: experimental studies and quantum mechanical calculations 期刊论文  OAI收割 ACTA PHARMACOLOGICA SINICA, 2013, 卷号: 34, 期号: 11, 页码: 1475-1483 作者:  Yu, Zhe;  Ma, Yu-chi;  Ai, Jing;  Chen, Dan-qi;  Zhao, Dong-mei   |  收藏  |  浏览/下载：16/0  |  提交时间：2019/01/08 receptor tyrosine kinase  type I c-Met inhibitor  cancer  quantum chemistry  protein-ligand interaction  symmetry-adapted perturbation theory (SAPT)   Non-Covalent Interactions with Aromatic Rings: Current Understanding and Implications for Rational Drug Design 期刊论文  OAI收割 CURRENT PHARMACEUTICAL DESIGN, 2013, 卷号: 19, 期号: 36, 页码: 6522-6533 作者:  Li, Shanshan;  Xu, Yuan;  Shen, Qiancheng;  Liu, Xian;  Lu, Jing   |  收藏  |  浏览/下载：20/0  |  提交时间：2019/01/08 pi-pi interactions  cation-pi interactions  anion-pi interactions  quantum mechanical calculations  crystallographic data mining  rational drug design  Acetylcholine esterase (AChE)  HMG-CoA reductase (HMGR)  serine protease factor Xa (fXa)