Projects per year
Personal profile
Research interests
Chemical Engineering - Chemical process design and optimization
Computer Science / Information Technology - Artificial intelligence
Chemical Engineering - Polymer
Chemical Engineering - Reactor engineering
Computer Science / Information Technology - Artificial intelligence
Chemical Engineering - Polymer
Chemical Engineering - Reactor engineering
Expertise related to UN Sustainable Development Goals
In 2015, UN member states agreed to 17 global Sustainable Development Goals (SDGs) to end poverty, protect the planet and ensure prosperity for all. This person’s work contributes towards the following SDG(s):
Related documents
Education/Academic qualification
PhD in Chemical and Biological Engineering, PhD, Northwestern University
2017
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Collaborations and top research areas from the last five years
Recent external collaboration on country/territory level. Dive into details by clicking on the dots or
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Transforming Skincare: Biocompatible NADES-based Dry Facial Masks for Hydration, Anti-aging, and Skin Repair through Needleless Electrospinning
WONG, L. H. (Team member), GAO, H. (CoI), HSING, I.-M. (PI), WONG, C. K. K. (Team member), FENG, X. (Team member), XIA, X. (Team member) & LI, Y. (Team member)
Innovation and Technology Commission, Nanoshields Technology Limited
1/09/25 → 31/08/28
Project: Research
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Combining Kinetic Monte Carlo and Machine Learning for Computational Design of Functional Polymers Prepared by Controlled Radical Polymerization
GAO, H. (PI)
1/01/23 → 30/06/26
Project: Research
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Research output
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A Multitask Learning Model for Predicting Various Types of Metal–Organic Framework Stability
Zhang, S., Wang, Z., Gao, H. & Zhou, T., 23 Jul 2025, In: Industrial and Engineering Chemistry Research. 64, 29, p. 14576-14589 14 p.Research output: Contribution to journal › Journal Article › peer-review
1 Citation (Scopus) -
Computational discovery and systematic analysis of protein entangling motifs in nature: from algorithm to database
Deng, P., Zhang, Y., Xu, L., Lyu, J., Li, L., Sun, F., Zhang, W. B. & Gao, H., 31 Mar 2025, In: Chemical Science. 16, 20, p. 8998-9009 12 p.Research output: Contribution to journal › Journal Article › peer-review
Open Access1 Citation (Scopus) -
Covalent Organic Framework-Oriented Chain Growth for High-Performance Polyolefins
Xiao, Y., Chen, X., Huang, X., Liu, K., Zhu, B., Li, W., Sun, M., Wang, H., Shi, S., Ye, Z., Gao, H., Wang, W. J., Li, B. G. & Liu, P., 9 Sept 2025, In: Macromolecules. 58, 17, p. 9075-9082 8 p.Research output: Contribution to journal › Journal Article › peer-review
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CSstep: Step-by-step exploration of the chemical space of drug molecules via multi-agent and multi-stage reinforcement learning
Che, X., Zhao, Y., Liu, Q., Yu, F., Gao, H. & Zhang, L., 1 Nov 2025, In: Chemical Engineering Science. 317, 122048.Research output: Contribution to journal › Journal Article › peer-review
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Deep Learning-Assisted Discovery of Protein Entangling Motifs
Deng, P., Xu, L., Wei, Y., Sun, F., Li, L., Zhang, W. B. & Gao, H., 10 Mar 2025, In: Biomacromolecules. 26, 3, p. 1520-1529 10 p.Research output: Contribution to journal › Journal Article › peer-review
2 Citations (Scopus)
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Automatic Chemical Information Extraction Using Deep Learning and Large Language Models
GAO, H. (Invited speaker)
17 May 2025Activity: Talk or presentation › Keynote
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Machine Learning for Chemical Synthesis Planning and Development
GAO, H. (Invited speaker)
16 Nov 2024Activity: Talk or presentation › Invited
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Using Kinetic Monte Carlo Simulations and Active Learning to Design Synthesis Recipe for Desired Molecular Weight and Sequence Distributions
GAO, H. (Invited speaker)
21 Sept 2024Activity: Talk or presentation › Invited
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Machine Learning Aided Synthesis Planning and Chemical Information Extraction
GAO, H. (Invited speaker)
11 Aug 2024Activity: Talk or presentation › Invited
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AI Assisted Automated Chemical Synthesis Planning and Execution
GAO, H. (Invited speaker)
20 Jul 2024Activity: Talk or presentation › Keynote