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Molecular insights into the catalytic promiscuity of a bacterial diterpene synthase 期刊论文
NATURE COMMUNICATIONS, 2023, 卷号: 14, 期号: 1, 页码: 15
作者:  Li, Zhong;  Zhang, Lilan;  Xu, Kangwei;  Jiang, Yuanyuan;  Du, Jieke
收藏  |  浏览/下载:8/0  |  提交时间:2023/12/13
Triangular Interchalcogen Interactions: A Joint Crystallographic Data Analysis and Theoretical Study 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2021, 卷号: 125, 期号: 19, 页码: 4173-4183
作者:  Wang, Ranran;  Lu, Yunxiang;  Xu, Zhijian;  Liu, Honglai
收藏  |  浏览/下载:18/0  |  提交时间:2021/08/17
Preorganization-enhanced halogen bonding via intramolecular hydrogen bonding: a theoretical study 期刊论文
STRUCTURAL CHEMISTRY, 2020, 页码: 11
作者:  Huang, Yanling;  Zhang, Shaoze;  Xu, Zhijian;  Liu, Honglai;  Lu, Yunxiang
收藏  |  浏览/下载:63/0  |  提交时间:2020/12/24
Theoretical Exploration of Halogen Bonding Interactions in the Complexes of Novel Nitroxide Radical Probes and Comparison with Hydrogen Bonds 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2018, 卷号: 122, 期号: 22, 页码: 5058-5068
作者:  Zhao, Chengxi;  Lu, Yunxiang;  Zhu, Zhengdan;  Liu, Honglai
收藏  |  浏览/下载:14/0  |  提交时间:2019/01/08
The interactions between imidazolium-based ionic liquids and stable nitroxide radical species: a theoretical study 期刊论文
Journal of physical chemistry a, 2016, 卷号: 120, 期号: 30, 页码: 6089-6102
作者:  Zhang, Shaoze;  Wang, Guimin;  Lu, Yunxiang;  Zhu, Weiliang;  Peng, Changjun
收藏  |  浏览/下载:35/0  |  提交时间:2019/05/09
The Interactions between Imidazolium-Based Ionic Liquids and Stable Nitroxide Radical Species: A Theoretical Study 期刊论文
JOURNAL OF PHYSICAL CHEMISTRY A, 2016, 卷号: 120, 期号: 30, 页码: 6089-6102
作者:  Zhang, Shaoze;  Wang, Guimin;  Lu, Yunxiang;  Zhu, Weiliang;  Peng, Changjun
收藏  |  浏览/下载:12/0  |  提交时间:2019/01/08
Halogen bonding interactions in ion pairs versus conventional charge-assisted and neutral halogen bonds: a theoretical study based on imidazolium species 期刊论文
RSC ADVANCES, 2015, 卷号: 5, 期号: 91, 页码: 74284-74294
作者:  Zhang, Shaoze;  Chen, Zhaoqiang;  Lu, Yunxiang;  Xu, Zhijian;  Wu, Weihong
收藏  |  浏览/下载:10/0  |  提交时间:2019/01/08
Theoretical Study on the UVR8 Photoreceptor: Sensing Ultraviolet-B by Tryptophan and Dissociation of Homodimer 期刊论文
journal of chemical theory and computation, 2014, 卷号: 10, 期号: 8, 页码: 3319-3330
作者:  Li, Xin;  Chung, Lung Wa;  Morokuma, Keiji;  Li, Guohui
收藏  |  浏览/下载:31/0  |  提交时间:2015/11/17
Energy Decomposition Scheme Based on the Generalized Kohn-Sham Scheme 期刊论文
http://dx.doi.org/10.1021/jp500405s, 2014
Su, Peifeng; Jiang, Zhen; Chen, Zuochang; Wu, Wei; 苏培峰; 吴玮
收藏  |  浏览/下载:4/0  |  提交时间:2015/07/22


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