宋希彤，1993年出生，理学博士，副教授；2023年博士毕业于厦门大学，同年作为福建省委组织部科研类引进人才加入beat365英国官方网站环境与生物工程学院。曾获得厦门大学化学化工学院和光长江奖学金、“厦门理论化学论坛”优秀奖、厦门大学校级奖学金、省级人才等荣誉。迄今，在ACS Catal. Chinese J. Catal. J. Chem. Theory. Comput. 等知名期刊上发表多篇高质量论文。
研究方向
研究方向主要聚焦在金属酶体系的量子－经典力学模拟（QM/MM）、酶催化过程的自由能计算、酶催化机理，以及酶的理性改造、生物催化、仿生催化、金属配合物在有机合成与环境催化中的作用机理以及生物大分子体系的动力学模拟等多个方面。
研究项目
1. 多尺度理论计算探究 PS II 催化水氧化的电子、质子转移及构象变化 校级启动经费 2024 主持 20万元 在研
2. PSII-S2异构体构象转变机理研究：揭示结构与催化作用的相关性 2024 主持 10 万元 在研
3. 金属酶中氧气活化机制的多尺度理论模拟 基金委面上项目 2021 参与已结题
论文著作
1. Ziqi Liang,# Xitong Song#, Shuming Cheng, Yiwen Shen, Jie Zhang, Yaru Wang, Huiying Luo, Bin Yao*, Binju Wang*, Tao Tu*.Synergistic Tuning of Conformational Dynamics, Electron Tunneling, and Substrate Positioning Enhances Electron Transfer in a P450 Chimera for Calcifediol Biosynthesis. Adv. Sci., 2026; 0:e19381.
2. Xitong Song, Binju Wang*.QM/MM Unlocks The Catalytic Mechanism of YtfE: The Structural Reorganization of The Active Site Enables Nitrite-to-NO Conversion. Chem. Eur. J. 2025, 31, e202500817.
3. Xitong Song,# Qian Wang,# Xiaoxi Zhu,# Wenhan Fang,# Xiaonan Liu, Chao Shi, Zhenzhan Chang,*Huifeng Jiang,* and Binju Wang*. Unraveling the Catalytic Mechanism of Taxadiene-5α-hydroxylase from Crystallography and Computational Analyses. ACS Catal., 2024, 14, 3912−3925.
4. Xitong Song, Jia Liu, and Binju Wang*. Emergence of Function from Nonheme Diiron Oxygenases: A Quantum Mechanical/Molecular Mechanical Study of Oxygen Activation and Organophosphonate Catabolism Mechanisms by PhnZ. ACS Catal., 2022, 12, 2009-2022.
5. Xitong Song and Binju Wang*. O−O Bond Formation and Oxygen Release in Photosystem II Are Enhanced by Spin-Exchange and Synergetic Coordination Interactions. J. Chem. Theory Comput., 2023, 19, 2684-2696.
6. Ke Wang, Xitong Song, Boya Cui, Yi Wang, and Wei Luo，Metabolic Engineering of Escherichia coli for Efficient Production of Ectoine. J. Agric. Food Chem. 2025 73 (1), 646-654. DOI: 10.1021/acs.jafc.4c07640.
7. Aito Li#, Qian Wang#, Xitong Song#, Rey-Ting Guo,* Binju Wang,* Manfred T. Reetz*. Engineering of a P450-based Kemp eliminase with a new mechanism" has been successfully submitted online and is presently being given full consideration for publication in the Chinese Journal of Catalysis. CHINESE J. CATAL., 2023,47,191–199.
8. Boxuan Yang; Xitong Song; Binju Wang ; DFT mechanistic study of biomimetic diiron complex catalyzed dehydrogenation: Unexpected Fe(III)Fe(III)-1,1-μ-hydroperoxy active species for hydride abstraction, J. Inorg. Biochem., 2024, 251: 112426.
9. Xitong Song, Xiaoqi Li and Jiayuan Qi*. Theoretical studies on the structural and spectral properties of two specific C54 isomers and the chlorinated species C54Cl8. RSC Adv., 2018, 8, 32731.
10. Mei Zheng, Xitong Song, Xiaoqi Li and Jiayuan Qi*. Theoretical studies on the structural and spectra properties of two C74 fullerenes and the chlorinated species C74Cl10. Mol. Phys., 2018, 116, 1772– 1781.
11. Xiaoqi Li, Xiaoxi Song, Xitong Song, and Jiayuan Qi*. Theoretical Studies on the Structural and Spectral Properties of Several Classical and Nonclassical C78 Isomers and Its Novel Chlorinated Derivative C78Cl24. J. Phys. Chem. C, 2019, 123, 13837-13845.
联系方式
邮箱：xtsong_Aprilis@163.com
