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Photochemical Synthesis of Nonplanar Small Molecules with Ultrafast Nonradiative Decay for Highly Efficient Phototheranostics 期刊论文
ADVANCED MATERIALS, 2021, 页码: 10
Authors:  Li, Xiaozhen;  Zhang, Di;  Lu, Guihong;  He, Tingchao;  Wan, Yingpeng;  Tse, Man-Kit;  Ren, Can;  Wang, Pengfei;  Li, Shengliang;  Luo, Jingdong;  Lee, Chun-Sing
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molecular motion  nonplanar small molecules  photoacoustic imaging  photochemical reaction  photothermal therapy  
A Diradicaloid Small Molecular Nanotheranostic with Strong Near-Infrared Absorbance for Effective Cancer Photoacoustic Imaging and Photothermal Therapy 期刊论文
ACS APPLIED MATERIALS & INTERFACES, 2021, 卷号: 13, 期号: 14, 页码: 15983-15991
Authors:  Li, Xiaozhen;  Zhang, Di;  Yin, Chao;  Lu, Guihong;  Wan, Yingpeng;  Huang, Zhongming;  Tan, Jihua;  Li, Shengliang;  Luo, Jingdong;  Lee, Chun-Sing
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Diradical  Near-infrared  Small Molecule  Photoacoustic Imaging  Photothermal Therapy  
Study of high density polyethylene (HDPE) pyrolysis with reactive molecular dynamics 期刊论文
POLYMER DEGRADATION AND STABILITY, 2014, 卷号: 104, 期号: 1, 页码: 62-70
Authors:  Liu, Xiaolong;  Li, Xiaoxia;  Liu, Jian;  Wang, Ze;  Kong, Bin;  Gong, Xiaomin;  Yang, Xiaozhen;  Lin, Weigang;  Guo, Li
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Reaxff Md  Hdpe Pyrolysis  Chemical Reaction Mechanism  Reactive Molecular Dynamics  Varmd  
Two mechanisms of polymer chain crystallization within nanoglobule 期刊论文
POLYMER, 2013, 卷号: 54, 期号: 15, 页码: 4030-4036
Authors:  Wang, Simiao;  Kong, Bin;  Nies, Erik;  Li, Xiaoxia;  Yang, Xiaozhen
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Polymer Crystallization  Nanoglobule  Molecular Dynamics  
聚合物纳米球结晶机理的计算机模拟 期刊论文
中国科学:化学, 2013, 期号: 01, 页码: 49-54
Authors:  王思邈;  陶晓芳;  石静;  孔滨;  余翔;  刘文志;  聂峰光;  李晓霞;  杨小震
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聚乙烯纳米球  高分子结晶  Avrami方程  分子动力学  图形处理器(Gpu)  
水在纳米管道中流动行为的分子动力学模拟 期刊论文
高等学校化学学报, 2012, 卷号: 033, 期号: 012, 页码: 2727
Authors:  饶欢;  杨文泓;  王思邈;  孔滨;  刘文志;  李晓霞;  杨小震
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分子动力学模拟LINCS约束算法的GPU并行化 期刊论文
计算机与应用化学, 2012, 期号: 08, 页码: 907-912
Authors:  刘忠亮;  李晓霞;  石静;  郭力;  孔滨;  杨小震
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分子动力学(Md)  Lincs约束算法  Gpu  Cuda  Gromacs  
建立基于GPU的分子动力学模拟程序GMD的尝试 会议论文
第十一届全国计算(机)化学学术会议论文摘要集, 中国甘肃兰州, 2011-08-05
Authors:  刘文志;  李晓霞;  聂峰光;  李伯杨;  郭力;  余翔;  杨小震;  杨文泓;  王思邈
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分子动力学  综述  Gpu  Md程序  聚乙烯结晶过程模拟  
Molecular dynamics simulation of macromolecules using graphics processing unit 期刊论文
MOLECULAR SIMULATION, 2010, 卷号: 36, 期号: 14, 页码: 1131-1140
Authors:  Xu, Ji;  Ren, Ying;  Ge, Wei;  Yu, Xiang;  Yang, Xiaozhen;  Li, Jinghai;  Ge, W
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Macromolecule  Molecular Dynamics  Speedup  Gpu  Cuda  
分子动力学模拟中基于GPU的范德华非键作用计算 期刊论文
计算机与应用化学, 2010, 期号: 12, 页码: 1607-1612
Authors:  刘文志;  李晓霞;  余翔;  杨小震;  郭力
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分子动力学  Gpu  Nvidia  Cuda  Gromacs  邻居搜索  范德华力