宋希彤个人简介

宋希彤 教师个人简介

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，同年作为福建省组织部科研类引进人才加入1671金沙城线路检测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. 金属酶催化机制与理性改造 国家优秀青年科学基金 2021 参与已结题

4. 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. 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-hydroxylasefrom Crystallography and Computational Analyses. ACS Catal., 2024,14, 3912−3925. 中科院一区

2. 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. 中科院一区

3. 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. 中科院一区

4. 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. 中科院一区

5. 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. 中科院一区

6. Boxuan Yang; Xitong Song; Binju Wang ; DFT mechanistic study of biomimetic diiron complexcatalyzed dehydrogenation: Unexpected Fe(III)Fe(III)-1,1-μ-hydroperoxy active species forhydride abstraction, J. Inorg. Biochem., 2024, 251: 112426.中科院二区

7. Xitong Song, Xiaoqi Li and Jiayuan Qi*. Theoretical studies on the structural and spectral properties of two specific C₅₄ isomers and the chlorinated species C₅₄Cl_8.RSC Adv., 2018, 8, 32731. 中科院三区

8. 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 C₇₄Cl_10.Mol. Phys., 2018, 116, 1772– 1781.

9. 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

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