| [1] |
WENG Meiqi, SHANG Guiming, WANG Jiatai, LI Shenghua, FAN Zhi, LIN Song, GUO Minjie.
Template Simulation of Organophosphorus Nerve Agent Molecularly Imprinted Polymers
[J]. Chem. J. Chinese Universities, 2022, 43(8): 20220136.
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| [2] |
GAO Zhiwei, LI Junwei, SHI Sai, FU Qiang, JIA Junru, AN Hailong.
Analysis of Gating Characteristics of TRPM8 Channel Based on Molecular Dynamics
[J]. Chem. J. Chinese Universities, 2022, 43(6): 20220080.
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| [3] |
HU Bo, ZHU Haochen.
Dielectric Constant of Confined Water in a Bilayer Graphene Oxide Nanosystem
[J]. Chem. J. Chinese Universities, 2022, 43(2): 20210614.
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| [4] |
ZHANG Mi, TIAN Yafeng, GAO Keli, HOU Hua, WANG Baoshan.
Molecular Dynamics Simulation of the Physicochemical Properties of Trifluoromethanesulfonyl Fluoride Dielectrics
[J]. Chem. J. Chinese Universities, 2022, 43(11): 20220424.
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| [5] |
ZHOU Chengsi, ZHAO Yuanjin, HAN Meichen, YANG Xia, LIU Chenguang, HE Aihua.
Regulation of Silanes as External Electron Donors on Propylene/butene Sequential Polymerization
[J]. Chem. J. Chinese Universities, 2022, 43(10): 20220290.
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| [6] |
LEI Xiaotong, JIN Yiqing, MENG Xuanyu.
Prediction of the Binding Site of PIP2 in the TREK-1 Channel Based on Molecular Modeling
[J]. Chem. J. Chinese Universities, 2021, 42(8): 2550.
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| [7] |
LI Congcong, LIU Minghao, HAN Jiarui, ZHU Jingxuan, HAN Weiwei, LI Wannan.
Theoretical Study of the Catalytic Activity of VmoLac Non-specific Substrates Based on Molecular Dynamics Simulations
[J]. Chem. J. Chinese Universities, 2021, 42(8): 2518.
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| [8] |
ZENG Yonghui, YAN Tianying.
Vibrational Density of States Analysis of Proton Hydration Structure
[J]. Chem. J. Chinese Universities, 2021, 42(6): 1855.
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| [9] |
QI Renrui, LI Minghao, CHANG Hao, FU Xueqi, GAO Bo, HAN Weiwei, HAN Lu, LI Wannan.
Theoretical Study on the Unbinding Pathway of Xanthine Oxidase Inhibitors Based on Steered Molecular Dynamics Simulation
[J]. Chem. J. Chinese Universities, 2021, 42(3): 758.
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| [10] |
LIU Aiqing, XU Wensheng, XU Xiaolei, CHEN Jizhong, AN Lijia.
Molecular Dynamics Simulation of Polymer/rod Nanocomposite
[J]. Chem. J. Chinese Universities, 2021, 42(3): 875.
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| [11] |
FAN Juanjuan, HAN Yuanyuan, CUI Jie.
Monte Carlo Simulation of the Transformation Control of ABC Triblock Copolymer Micelles from Multicompartment Structure to Multicore Structure
[J]. Chem. J. Chinese Universities, 2021, 42(3): 857.
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| [12] |
YE Chenghao, LIANG Heng, LI Enmin, XU Liyan, LI Peng, CHEN Guanghui.
High-throughput Virtual Screening of CDK2/Cyclin A2 Target Inhibitors
[J]. Chem. J. Chinese Universities, 2021, 42(10): 3135.
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| [13] |
LI Xiangyuan,YAO Xiaoxia,SHENTU Jiangtao,SUN Xiaohui,LI Juanqin,LIU Mingxia,XU Shimin.
Combustion Reaction Mechanism Construction by Two-parameter Rate Constant Method †
[J]. Chem. J. Chinese Universities, 2020, 41(3): 512.
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| [14] |
WANG Xiaoxia, MA Litong, NIE Zhihua, WANG Zhengde, CUI Jinlong, ZHAO Wenyuan, SAI Huazheng.
Interaction Between Fulvic Acid and Pepsin Investigated by Multispectral and Molecular Docking Simulation †
[J]. Chem. J. Chinese Universities, 2019, 40(9): 1840.
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| [15] |
CHENG Xiankun, HOU Xue, TIAN Huan, ZHANG Menglong, WEI Hao, ZHAO Zhuo.
Synthesis of Macrocyclic Thiacrown Ethers and Their Selective Extraction for Ag(Ⅰ) and Tl(Ⅰ) †
[J]. Chem. J. Chinese Universities, 2019, 40(9): 1881.
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