Welcome to the personal website Jourmore
Bioinformatics and Cheminformatics (MD & AI)
Machine learning (ML) & Deep learning (DL)
Molecular dynamics simulations (MD)
Database & Tool & Web
1.Research
1) AI Chemoinformatics and Bioinformatics
NBsTem: Nanobody Thermostability Prediction by using AI & MD & WEB.
NBsPocket: Nanobody Pocket database & Reverse screening.
ANPred: Deep learning framework and training strategies for Physical-Chemical Properties Prediction of Antibody & Nanobody.
2) Drug Discovery, Molecular modelling and Machine learning
Computational Toxicology (Machine Learning): Developmental toxicity, Ototoxicity, Reproductive toxicity, Neurotoxicity.
Computer-aided drug Screening and Design (CADD & AIDD & MD): Tubulin*6 and other targets.
3) Biomedical experiment and Bioinformatics
Genetic engineering & Cell engineering technology.
Bioinformatics - Sequence and Omics analysis.
Publications
[1] Mao J, Luo QQ, Zhang HR, Zheng XH, Shen C, Qi HZ, Hu ML, Zhang H. Chem Biol Interact. 2022 Jan 25;352:109784.link
[2] Pan CC, Yang CM, Mao J*. Asian J Psychiatr. 2025 Aug 23.link
[3] Yang MH, Mao J#, Zhu JH, Zhang H, Ding L. Life Sci. 2022 Apr 30:120583.link
[4] Li YL, Mao J#, Tian XF, Song H, Ren JX. J Mol Struct. 2025 Mar 5;1324:140905.link
[5] Li YL, Mao J#, Cheng Z, Zhou XY, Zhang DN, Li YZ, Cao ZX, Ren JX. Mol Divers. 2025 Apr 16.link
[6] Zhang H, Mao J#, Qi HZ, Xie HZ, Shen C, Liu CT, Ding L. Food Chem Toxicol. 2020 Sep;143:111513.link
[7] Zhang H, Mao J#, Yang YL, Liu CT, Shen C, Zhang HR, Xie HZ, Ding L. J Cell Biochem. 2021 Nov;122(11):1609-1624.link
[8] Zhang H, Mao J#, Qi HZ, Ding L. Mol Divers. 2020 Nov;24(4):1281-1290.link
[9] Kong M, Chen X, Mao J, Yu J, Song YP, Guo YZ, Pu XM. JCTC. 2025.
[10] Hu, J, Yang, SR, Mao, J, Shi, CJ, Wang, GC, Liu, YJ, Pu, XM. J Alloy Compd, 2023, 947, 169479.link
[11] Zhang H, Qi HZ, Mao J, Zhang HR, Luo QQ, Hu ML, Shen C, Ding L. Bioorg Chem. 2022 Mar 12;122:105722.link
[12] Zhang H, Liu CT, Mao J, Shen C, Xie RL, Mu B. Toxicol In Vitro. 2020 Jun;65:104812.link
[13] Zhang H, Shen C, Liu RZ, Mao J, Liu CT, Mu B. J Appl Toxicol. 2020 Sep;40(9):1198-1209.link
[14] Chen X, Wang K, Chen J, Wu C, Mao J, Song Y, Liu Y, Shao Z, Pu X. Nat Commun. 2024 Sep 16;15(1):8130.link
[15] Patent: ZL202211500668.3，2023.9.8.
[16] First author [Under Review] (Conformation Dynamics Informed Synergistic Dual-Scale Deep Learning for Reliable Nanobody Thermostability Prediction.)
[17] First author [Under Review] (Overcoming Data Scarcity: Active Learning-Driven Multimodal Fusion for Property Prediction of Nanobody and Antibody.)
[18] First author [In Submitting] (NBsPocket: A Nanobody Pocket Database Driven by Real Structure, Physical Simulation and AI Prediction.)
[19] Co-first author [Under Review] (Bridging Machine Learning and Physics: Blood-Brain Barrier Permeability Prediction and Molecular Dynamics Validation.)
[20] Co-first author [Under Review] (From Targets to Therapies: Computational Discovery of Anti-Glioblastoma Agents with Multimodal Mechanisms.)
[1] NBsTem: Nanobody Thermostability Prediction by using AI & MD & WEBlink
[2] NBsPocket: Coming soon
[3] ANPred: Coming soon
[4] SchNet: AI models for Schizophrenia Predictionlink
[Other tools will be released after being sorted out.]
Links
For Antibody & Nanobody
[1] SAbDab: a database containing all the antibody structures available in the PDB.link
[2] SAbDab-nano: a sub-database of SAbDab containing all single-domain antibody structures available in the PDB.link
[3] SAbPred: a collection of computational tools that make predictions about the properties of antibodies, focusing on their structures.link
[Other links will be released after being sorted out.]
About
Bioinformatics and Cheminformatics in College of Chemistry at SCU
2022-2026: PhD
Biochemistry and Molecular Biology, Computer-aided drug design & Computational toxicology
2019-2022: Master
Bioinformatics in Zhejiang University
2017-2019: Research Assistant
Biotechnology, Genetic engineering & Cell engineering
2014-2018: Undergraduate
Jourmore
maojun@stu.scu.edu.cn
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