• 个人资料

  • 个人简介

    浙江工业大学生物工程学院教师，青年教师（讲师）。籍贯河南商丘，1994年12月出生，2021年6月博士毕业于中山大学药学院，曾获得中山大学研究生国家奖学金。研究内容涉及生物大分子多尺度模拟、化学反应机理计算和计算机辅助药物设计等。主要借助量子-经典力学组合（QM/MM）的多尺度模拟方法在电子和原子层面，围绕酶催化机制解析以及抑制剂设计等开展研究工作。

  • 科研成果

    代表性论文论著

    1. Hongjuan Diao#, Nanhao Chen#, Kai Wang, Fan Zhang, Yong-Heng Wang*, and Ruibo Wu*. Biosynthetic Mechanism of Lanosterol: A Completed Story. ACS Catal. 2020, 10, 2157-2168.

    2. Yufan Qiu, Hongjuan Diao, Ying Zheng, Ruibo Wu*. Multiscale Simulations on the Catalytic Plasticity of CYP76AH1.Front. Chem. 2021.9, 689731.

    3. Wengan He, Danhong Liang, Kai Wang, Nan Lyu, Hongjuan Diao, Ruibo Wu* AromTool: Predict Aromatic Stacking Energy Using an Atomic Neural Network Model. Phys.Chem.Chem.Phys. 2021, 23, 16044-16052.

    4. Jun Sang, Wei Li, Hong-Juan Diao, Run-Zhu Fan, Jia-Luo Huang, Lu Gan, Ming-Feng Zou,Gui-Hua Tang, Sheng Yin*. Jolkinolide B targets thioredoxin and glutathione systems to induce ROS-mediated paraptosis and apoptosis in bladder cancer cells. Cancer Letters. 2021, 509, 13–25.

    5. Kai Wang#, Nan Lyu#, Hongjuan Diao, Shujuan Jin, Tao Zeng, Yaoqi Zhou*, Ruibo Wu*. GM-DockZn: A Geometry Matching based Docking Algorithm for Zinc Proteins. Bioinformatics. 2020, 36, 4004-4011.

    6. Wen-Run Zhu, Qiong Su, HongJuan Diao, Er-Xuan Wang, Feng Wu, Yun-Long Zhao, Jiang Weng*,  Gui Lu*. Enantioselective Dehydrative γ-Arylation of α-Indolyl Propargylic Alcohols with Phenols: Access to Chiral Tetrasubstituted Allenes and Naphthopyrans. Org. Lett. 2020, 22, 6873–6878.

    7. Tao Zeng#, Zhihong Liu#, Jingyuan Zhuang, Yitao Jiang, Wengan He, Hongjuan Diao, Nan Lv, Yongxing Jian, Danhong Liang, Yufan Qiu, Rong Zhang, Fan Zhang, Xiaowen Tang, Ruibo Wu*. TeroKit: A Database-Driven Web Server for Terpenome Research. J. Chem. Inf. Model. 2020, 60, 4, 2082-2090.

    8. Yong-Heng Wang, Fan Zhang, Hongjuan Diao, and Ruibo Wu*. The Covalent Inhibition Mechanism of Antidiabetic Drugs--Vildagliptin vs Saxagliptin. ACS Catal. 2019, 9, 2292-2302.

    9. Chunyan Cheng, Hongjuan Diao, Fan Zhang, Yongheng Wang, Kai Wang*, Ruibo Wu*. Deciphering the Selective Inhibition Mechanisms of BD2 inhibitors for BET bromodomains. Phys.Chem.Chem.Phys. 2017, 19, 23934-23941.







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更新时间：
2023-03-09
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更新时间：2023.03.09

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  • 电子邮箱： diaohj5@zjut.edu.cn
  • 办公地址： 浙江工业大学莫干山校区生物工程学院

  • 个人简介

    浙江工业大学生物工程学院教师，青年教师（讲师）。籍贯河南商丘，1994年12月出生，2021年6月博士毕业于中山大学药学院，曾获得中山大学研究生国家奖学金。研究内容涉及生物大分子多尺度模拟、化学反应机理计算和计算机辅助药物设计等。主要借助量子-经典力学组合（QM/MM）的多尺度模拟方法在电子和原子层面，围绕酶催化机制解析以及抑制剂设计等开展研究工作。

  • 科研成果

    代表性论文论著

    1. Hongjuan Diao#, Nanhao Chen#, Kai Wang, Fan Zhang, Yong-Heng Wang*, and Ruibo Wu*. Biosynthetic Mechanism of Lanosterol: A Completed Story. ACS Catal. 2020, 10, 2157-2168.

    2. Yufan Qiu, Hongjuan Diao, Ying Zheng, Ruibo Wu*. Multiscale Simulations on the Catalytic Plasticity of CYP76AH1.Front. Chem. 2021.9, 689731.

    3. Wengan He, Danhong Liang, Kai Wang, Nan Lyu, Hongjuan Diao, Ruibo Wu* AromTool: Predict Aromatic Stacking Energy Using an Atomic Neural Network Model. Phys.Chem.Chem.Phys. 2021, 23, 16044-16052.

    4. Jun Sang, Wei Li, Hong-Juan Diao, Run-Zhu Fan, Jia-Luo Huang, Lu Gan, Ming-Feng Zou,Gui-Hua Tang, Sheng Yin*. Jolkinolide B targets thioredoxin and glutathione systems to induce ROS-mediated paraptosis and apoptosis in bladder cancer cells. Cancer Letters. 2021, 509, 13–25.

    5. Kai Wang#, Nan Lyu#, Hongjuan Diao, Shujuan Jin, Tao Zeng, Yaoqi Zhou*, Ruibo Wu*. GM-DockZn: A Geometry Matching based Docking Algorithm for Zinc Proteins. Bioinformatics. 2020, 36, 4004-4011.

    6. Wen-Run Zhu, Qiong Su, HongJuan Diao, Er-Xuan Wang, Feng Wu, Yun-Long Zhao, Jiang Weng*,  Gui Lu*. Enantioselective Dehydrative γ-Arylation of α-Indolyl Propargylic Alcohols with Phenols: Access to Chiral Tetrasubstituted Allenes and Naphthopyrans. Org. Lett. 2020, 22, 6873–6878.

    7. Tao Zeng#, Zhihong Liu#, Jingyuan Zhuang, Yitao Jiang, Wengan He, Hongjuan Diao, Nan Lv, Yongxing Jian, Danhong Liang, Yufan Qiu, Rong Zhang, Fan Zhang, Xiaowen Tang, Ruibo Wu*. TeroKit: A Database-Driven Web Server for Terpenome Research. J. Chem. Inf. Model. 2020, 60, 4, 2082-2090.

    8. Yong-Heng Wang, Fan Zhang, Hongjuan Diao, and Ruibo Wu*. The Covalent Inhibition Mechanism of Antidiabetic Drugs--Vildagliptin vs Saxagliptin. ACS Catal. 2019, 9, 2292-2302.

    9. Chunyan Cheng, Hongjuan Diao, Fan Zhang, Yongheng Wang, Kai Wang*, Ruibo Wu*. Deciphering the Selective Inhibition Mechanisms of BD2 inhibitors for BET bromodomains. Phys.Chem.Chem.Phys. 2017, 19, 23934-23941.







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