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发布时间:2023/12/08   阅读量:




董界,博士/特聘副教授/硕士生导师,2012年本科毕业于中南大学,2017年博士毕业于中南大学湘雅药学院药物化学系。2019年5月获批澳门大学“濠江博士后”计划,于澳门大学“中药质量研究国家重点实验室”进行博士后研究工作,2021年6月进入中南大学湘雅药学院工作。主要研究领域涉及:基于人工智能的分子设计,包括新型抗癌抗菌等活性分子设计与筛选,智能诊疗试剂开发,新型生物医学材料设计与筛选等;药物研发中的计算平台及数据库的开发,包括小分子、多肽药物ADMET性质预测,智能药物递送,智能诊疗分子性质预测等平台的开发。Research, Chem Eng J Brief Bioinform等期刊发表SCI论文50篇,其中多篇发表于领域内TOP期刊,被引用超过2000次。已发表10多个计算平台和数据库,获得项软件著作权和专利。主持国家自然科学青年基金1项,湖南省自然科学青年基金1项,参与国家重点研发计划、国家自然科学基金多项。荣获湖南省优秀博士学位论文,入选湖南省青年骨干教师2023年入选全球前2%顶尖科学家榜单。担任Asian Journal of Pharmaceutical Sciences杂志青年编委,另担任Frontiers in Bioengineering and Biology客座编辑以及Journal of Cheminformatics, Briefings in bioinformatics,Journal of Advanced Research等20SCI期刊审稿专家









Dong J, Wu Z, Xu H L, Ouyang D. FormulationAI: a novel web-based platform for drug formulation design driven by artificial intelligence. Briefings in bioinformatics 2024, 25(1), 1–10

McGibbon M#, Shave S#, Dong J#, et al. From intuition to AI: evolution of small molecule representations in drug discovery. Briefings in bioinformatics, 2024, 25(1), 1-13

Huang S, Feng B, Cheng X, Huang X, Ding J, Yu K, Dong J*, Zeng WB*. Controlling ESIPT-based AIE effects for designing optical materials with single-component white-light emission. Chemical Engineering Journal. 2023; 476:146436. (Top期刊,IF15.1)

Zhu Y, Qian J, Yu K, Hou J, Ma Y, Chen F, Dong J*, Zeng WB*. Intelligent design and construction of novel APN-based theranostic probe driven by advanced computational methods. Chinese Chemical Letters. 2023:108948. (Top期刊)

J Dong, J Qian, K Yu, et al. Rational Design of Organelle-Targeted Fluorescent Probes: Insights from Artificial Intelligence. Research, 2023, 6: 0075. (Top期刊IF: 11.036)

Mao J S, Guan S H, Chen Y Q, Zeb A, Sun Q X, Lu R L, Dong J*, Wang J M*, Cao D S*. Application of a deep generative model produces novel and diverse functional peptides against microbial resistance. Computational and Structural Biotechnology Journal, 2023,21: 463-471.

Dong J, Varbanov M, Philippot S, et al. Ligand-based discovery of coronavirus main protease inhibitors using MACAW molecular embeddings. Journal of Enzyme Inhibition and Medicinal Chemistry, 2023, 38(1): 24-35.

Zhang L X#, Dong J#, Wei H, et al. TCMSID: a simplified integrated database for drug discovery from traditional Chinese medicine. Journal of Cheminformatics, 2022, 14(1): 1-11

Yang Z F, Xiao R, Xiong G L, Lin Q L, Liang Ying, Zeng W B, Dong J*, Cao D S*. A novel multi-layer prediction approach for sweetness evaluation based on systematic machine learning modeling. Food Chemistry, 2022, 372: 131249. (TOP期刊)

Qian J, Song F L, Liang R, Wang X J, Liang Y, Dong J*, Zeng W B. NOAEL prediction and explanation by systematic comparison of different machine learning methods and descriptors. Food and Chemical Toxicology, 2022, 168: 113325. (TOP期刊)

Yang ZY#, Dong J#, Yang ZJ, et al. ChemFLuo: a web-server for structure analysis and identification of fluorescent compounds. Briefings in Bioinformatics. 2020. (IF: 13.994)

Dong J, Zhu M F, Yun Y H, et al. BioMedR: An R/CRAN package for integrated data analysis pipeline in biomedical study. Briefings in Bioinformatics. 2019. (IF: 13.994)

Dong J, Yao Z J, Zhang L, et al. PyBioMed: a python library for various molecular representations of chemicals, proteins and DNAs and their interactions [J]. Journal of Cheminformatics, 2018, 10(1): 16. (ESI高被引)

Dong J#, Wang N N#, Yao Z J, et al. ADMETlab: a platform for systematic ADMET evaluation based on a comprehensively collected ADMET database[J]. Journal of Cheminformatics, 2018, 10(1): 29. (ESI高被引)

Dong J, Cao D S, Miao H Y, et al. ChemDes: an integrated web-based platform for molecular descriptor and fingerprint computation[J]. Journal of Cheminformatics, 2015, 7(1): 1-10. (ESI高被引)



Google scholar: https://scholar.google.com/citations?user=phFGEecAAAAJ&hl=zh-CN

Website: http://www.ddai.tech

E-mail: jiedong@csu.edu.cn