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| Novel vanadium complexes with rigid carboxylate ligands: Synthesis, structure and catalytic bromine dynamics of phenol red 期刊论文
Journal of Molecular Structure, 2017, 卷号: Vol.1149, 页码: 379-386
作者: Yang Wang; Xiao-Meng Lin; Feng-Ying Bai; Li-Xian Sun
  收藏 | 浏览/下载：5/0 | 提交时间：2019/02/27
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| Study on properties of liquid ammonia via molecular dynamics simulation based on ABEEMσπ polarisable force field 期刊论文
Molecular Simulation, 2017, 卷号: Vol.43 No.13-16, 页码: 1099-1106
作者: Lan-Lan He; Shi-Yuan Zhang; Ting-Ting Sun; Chong-Li Zhao; Chao Zhang
收藏 | 浏览/下载：7/0 | 提交时间：2019/02/27
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| A salt-bridge switch in the molecular recognition between RS receptor and RGD ligand from the ABEEM σπ molecular dynamics simulations 期刊论文
Molecular Simulation, 2017, 卷号: Vol.43 No.13-16, 页码: 1045-1055
作者: Chao Zhang; Dong-Xia Zhao; Qian Wang; Ling Yu; Guo-Hui Li
收藏 | 浏览/下载：5/0 | 提交时间：2019/02/27
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| Studies on hydrolysis mechanism of anticancer ruthenium drug ImH[trans-Ru(Im)Cl] via ABEEMσπ polarizable force field combined with QM and MD-FEP 期刊论文
Chemical Research in Chinese Universities, 2017, 卷号: Vol.33 No.2, 页码: 239-247
作者: Hui Li; Huiyuan Zou; Linlin Liu; Dongxia Zhao; Zhongzhi Yang
收藏 | 浏览/下载：13/0 | 提交时间：2019/02/27
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| Intermolecular Vibrational Energy Transfers in Melts and Solutions 期刊论文
Chinese Journal of Chemical Physics, 2016, 卷号: 第29卷
作者: Yu-neng Shen; Bo Jiang; Chuan-qi Ge; Gang-hua Deng; Hai-long Chen
收藏 | 浏览/下载：4/0 | 提交时间：2019/03/08
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| Hermiticity of Hamiltonian Matrix using the Fourier Basis Sets in Bond-Bond-Angle and Radau Coordinates 期刊论文
化学物理学报(英文版), 2016, 卷号: 第29卷
作者: De-quan Yu; He Huang; Gunnar Nyman; Zhi-gang Sun
收藏 | 浏览/下载：13/0 | 提交时间：2019/03/08
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| ARTICLE Hermiticity of Hamiltonian Matrix using the Fourier Basis Sets in Bond-Bond-Angle and Radau Coordinates? 期刊论文
化学物理学报(英文版), 2016, 卷号: 第1期, 页码: 112-122
作者: De-quanYu; HeHuang; GunnarNyman; Zhi-gangSun
收藏 | 浏览/下载：5/0 | 提交时间：2019/03/14
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| Hermiticity of Hamiltonian Matrix using the Fourier Basis Sets in Bond-Bond-Angle and Radau Coordinates 期刊论文
Chinese Journal Of Chemical Physics, 2016, 卷号: Vol.29 No.1, 页码: 112-122
作者: De-quan Yu; He Huang; Gunnar Nyman; Zhi-gang Sun
收藏 | 浏览/下载：7/0 | 提交时间：2019/02/27
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| Intermolecular Vibrational Energy Transfers in Melts and Solutions 期刊论文
Chinese Journal of Chemical Physics, 2016, 卷号: Vol.29 No.4, 页码: 407
作者: Yu-neng Shen; Bo Jiang; Chuan-qi Ge; Gang-hua Deng; Hai-long Chen
收藏 | 浏览/下载：3/0 | 提交时间：2019/02/27
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| Some polarisable force fields for molecular dynamics simulations of lipids, and bilayers 期刊论文
Molecular Simulation, 2016, 卷号: Vol.42 No.10, 页码: 820-826
作者: Guo, Wei; Cheng, Liwei; Chu, Huiying; Cao, Liaoran; Zhang, Depeng
收藏 | 浏览/下载：5/0 | 提交时间：2019/02/27
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