[1] |
Haipeng Wang, Wensheng Cai, Xueguang Shao.
Antifreeze Mechanism of Antifreeze Agents by Near Infrared Spectroscopy and Molecular Simulations★
[J]. Acta Chimica Sinica, 2023, 81(9): 1167-1174.
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[2] |
Wenjie Wei, Wenlong Chen, Xiaobin Dai, Li-Tang Yan.
Theory of Anomalous Diffusion Dynamics in Biomacromolecular Media★
[J]. Acta Chimica Sinica, 2023, 81(8): 967-978.
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[3] |
Liu Zhenyu, Gan Li-Hua.
Molecular Dynamics Simulation of Acetylene Pyrolysis into Fullerenes
[J]. Acta Chimica Sinica, 2023, 81(5): 502-510.
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[4] |
Yanrong Jia, Kai Xu, Yanying Zhao, Huagang Ni, Ying Wu, Min Xia.
Research on Emission Behavior and Mechanofluorochromic Activity of Benzo[d]imidazoles with Region-isomerized Push-Pull Groups
[J]. Acta Chimica Sinica, 2023, 81(12): 1716-1723.
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[5] |
Juan Wang, Huamin Xiao, Ding Xie, Yuanru Guo, Qingjiang Pan.
Density Functional Theory Study of Structures of Copper-doped and Graphitic Carbon Nitride-combined Zinc Oxides and Their Boosted Nitrogen Dioxide-sensing Performance
[J]. Acta Chimica Sinica, 2023, 81(11): 1493-1499.
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[6] |
Yizhi Han, Jianhui Lan, Xue Liu, Weiqun Shi.
Advances in Molecular Dynamics Studies of Molten Salts Based on Machine Learning
[J]. Acta Chimica Sinica, 2023, 81(11): 1663-1672.
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[7] |
Ke Zhao, Xiayu Cheng, Xuexue Ma, Minghui Geng.
Mechanism of Two-photon Absorption Enhancement for a Piperazine-based Zinc Ion Probe
[J]. Acta Chimica Sinica, 2023, 81(10): 1371-1378.
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[8] |
Luocong Wang, Zhewei Li, Caiwei Yue, Peihuan Zhang, Ming Lei, Min Pu.
Theoretical Study on the Isomerization Mechanism of Azobenzene Derivatives under Electric Field
[J]. Acta Chimica Sinica, 2022, 80(6): 781-787.
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[9] |
Panqi Song, Jianqiao Zhang, Yiwen Li, Guangfeng Liu, Na Li.
Solution Small-Angle Scattering in Soft Matter: Application and Prospective※
[J]. Acta Chimica Sinica, 2022, 80(5): 690-702.
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[10] |
Bo Wu, Chong Wang, Baolin Li, Chunru Wang.
Light-driven Molecular Magnetic Switch for a Metallofullerene※
[J]. Acta Chimica Sinica, 2022, 80(2): 101-104.
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[11] |
Qing-Ru Zhao, Ru Jiang, Shu-Li You.
Ir-catalyzed Sequential Asymmetric Allylic Substitution/Olefin Isomerization for the Synthesis of Axially Chiral Compounds
[J]. Acta Chimica Sinica, 2021, 79(9): 1107-1112.
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[12] |
Yingzhe Du, Heng Zhang, Shiling Yuan.
Molecular Dynamics Simulation of Thermal Conductivity of Al2O3/PDMS Composites
[J]. Acta Chimica Sinica, 2021, 79(6): 787-793.
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[13] |
Chang-An Liu, Shi-Bo Hong, Bei Li.
Molecular Dynamics Simulation of the Stability Behavior of Graphene in Glycerol/Urea Solvents in Liquid-Phase Exfoliation
[J]. Acta Chimica Sinica, 2021, 79(4): 530-538.
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[14] |
Haohao Fu, Haochuan Chen, Hong Zhang, Xueguang Shao, Wensheng Cai.
Accurate Estimation of Protein-ligand Binding Free Energies Based on Geometric Restraints
[J]. Acta Chimica Sinica, 2021, 79(4): 472-480.
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[15] |
Yue Lu, Yang Ge, Manling Sui.
Different Degradation Mechanism of CH3NH3PbI3 Based Perovskite Solar Cells under Ultraviolet and Visible Light Illumination
[J]. Acta Chimica Sinica, 2021, 79(3): 344-352.
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