Projects per year
Personal profile
Particulars
Dr Meilan Huang is currently a Senior Lecturer (Associate Professor) at School of Chemistry and Chemical Engineering at Queen's University Belfast, Her research interest lies in developing and applying Molecular Modelling and Machine Learning methods for transition-metal catalysis, biocatalysis and photocatalysis. The group study the structure-function relationship and the catalytic mechanisms of a range of chemical transformations to guide the rational design of novel catalysts. Dr Huang is a Fellow of Royal Society of Chemistry (FRSC), and also a Fellow of Royal Society of Biology (FRSB).
Before joining Queen's as a lecturer in 2007, Dr Huang worked with Prof Fengling Qing in the Key Laboratory of Organoflorine Chemistry at Shanghai Institute of Organic Chemistry, Chinese Academy of Sciences in 1998-1999. She then pursued PhD in Computational Chemistry at Zhejiang University. After awarded the PhD degree in Feb 2003, she worked as a postdoc with Prof Arvi Rauk in the Department of Chemistry at University of Calgary Canada. She was a Welcome Trust research fellow in the Laboratory of Physical and Theoretical Chemistry at University of Oxford working with Prof W. Graham Richards, FRS in 2004-2006 and a research fellow working with Prof Artem Cherkasov in Department of Medicine at University of British Columbia, Canada in 2006-2007.
Dr Huang has published over 90 full research articles and reviews in high-impact peer-reviewed journals, as the Corresponding Author of majority of them, e.g. Chem Soc Rev, 2024, 10.1039/d4cs00196f, ChemCatChem, 2024, 10.1002/cctc.202400598, SOLAR RRL, 2024, 10.1002/solr.202400322, ACS Applied Materials and Interfaces, 2023, 10.1021/acsami.3c09761; Catal Sci Technol. 2023, 10.1039/D3CY00123G, Phys Chem Chem Phys. 2023, 10.1039/D3CP04019D; ACS Catalysis, 2022, 10.1021/acscatal.2c00013; ACS Applied Materials and Interfaces, 2022, 10.1021/acsami.2c13585; SOLAR RRL, 2022, 10.1002/solr.202101103; Inorganic Chemistry, 2021, 10.1021/acs.inorgchem.1c00468; J Phys Chem Lett. 2020, 10.1021/acs.jpclett.0c02105; Chem Comm, 2020, 10.1039/D0CC03721D; Phys Chem Chem Phys. 2020, 10.1039/D0CP03083J; Chem Comm, 2019, 10.1039/C8CC09951K, J Am Chem Soc, 2019, 10.1021/jacs.9b02709, Nature Communications, 2019, 10.1038/s41467-019-11155-3, ChemCatChem, 2019, 10.1002/cctc.201901200;J Phys Chem B, 2019, 10.1021/acs.jpcb.9b04227; J Phys Chem B, 2019, 10.1021/acs.jpcb.9b06064; J Phys Chem B, 2019, 10.1021/acs.jpcb.9b00547; Journal of Power Sources, 2018, 10.1016/j.jpowsour.2017.12.011, Phys Chem Chem Phys, 2018, 10.1039/C7CP07172H; Phys Chem Chem Phys. 2018, 10.1039/c8cp02860e;J Phys Chem B. 2017, 10.1021/acs.jpcb.7b08770; Phys Chem Chem Phys. 2017, 10.1039/c7cp03640j; J Phys Chem B. 2016, 10.1021/acs.jpcb.6b08480; ACS Catalysis, 2016, 10.1021/acscatal.6b02380,etc.
Dr Huang has led the Computational team in several major interdisciplinary research projects. She was the PI of Chemistry in the interdisciplinary biotechnological project “Development of a computational and molecular biology platform between QUB and Almac” (2015-2019). Dr Huang is the PI of Chemistry in a new 3-year project (2021-2024) INSIGHT@ "IN Silico-Informed metaGenomic Harvesting Technology", in close collaboration with experimentalists and industry. So far, she has secured over £2m research income with a share of £688k. As the principal investigator of the Computational Chemistry workpackage, having supervised 2 computational postdocs. As the principle invesstigator of the Machine Learning workpackage for INSIGHT@, supervising a postdoc, and have developed the Deep-Learning toolkits "ALDELE" for predicting functions of new biocatalysts (J. Chem. Inf. Model. 2024, 10.1021/acs.jcim.4c00058)
Group website: https://www.huanggroup.co.uk
Research Interests
Computational Chemistry and Biology;
Theoretical Biocatalysis;
Machine Learning and Statistical Potential;
Rational Molecular Design;
Photocatalytis;
Electric Field in Biocatalysis
Teaching
Current teaching commitments:
CCE Summer School Programme (Programme Lead)
Advisor of Stuides
Advisor of Studies (Intenational students)
CHE1107: Maths for Chemists and Engineers
CCE1102: Physical Chemistry Practical labs
CHM3005C: Computational Chemistry in Drug Discovery (Module Coordinator)
CHM4003: Advanced Physical Chemistry (Module Coordinator)
CHM3010: Practical Skills in Chemistry (Module Coordinator)
CHM3016: Drug Development
CHM4001: Chemistry Research Project
CHM7004: Research Project
Achievements
2021-2024: "INSIGHT: IN Silico Informed metaGenomic Harvesting Technology platform - Development of an advanced and secure enzyme discovery platform for Almac and QUB" Invest NI, RD11181114, £1,299,329. PI of Chemistry
2021-2023: Royal Society: IEC\NSFC\201177 - International Exchanges 2020 “Machine Learning-assisted Directed Evolution of Enzymes”. PI
2021: Newton Fund Research Links Workshop grant-2020-RLWK12-10149 "Catalytic Chemistry and Chemical Technology of C1 process" British Council. PI
2015-2019: "New Biotechnology: Development of Computational and Molecular Biology Platforms for Almac and QUB" Invest NI, RD3014092, £981,360. PI of Chemistry
2022: Innovation in Teaching Fund: VR Lab
2017: Queen's Student Union "Education Excellence Award"
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):
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Collaborations and top research areas from the last five years
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R3579CCE: Workshop on Low Carbon Green Development Utilising Clean Resources
Huang, M. (PI)
20/02/2024 → …
Project: Research
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R1511CCE: Machine Learning - assisted Directed Evolution of Enzymes
Huang, M. (PI)
21/04/2021 → …
Project: Research
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R3253GFS: IN Silico Informed metaGenomic Harvesting Technology platform (INSIGHT)
Allen, C. C. R. (PI), Gilmore, B. (CoI), Huang, M. (CoI) & Law, C. (CoI)
06/01/2021 → …
Project: Research
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R3292CCE: Catalytic Chemistry and Chemical Technology of C1 Process
Huang, M. (PI)
17/05/2021 → 31/12/2021
Project: Research
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R3671BSC: Development of computational and molecular biology platforms for Almac and QUB
Allen, C. C. R. (PI), Huang, M. (CoI) & Kulakov, L. (CoI)
21/11/2014 → 30/03/2019
Project: Research
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BioStructNet: structure-based network with transfer learning for predicting biocatalyst functions
Wang, X., Zhou, J., Mueller, J., Quinn, D., Carvalho, A., Moody, T. S. & Huang, M., 14 Jan 2025, In: Journal of Chemical Theory and Computation. 21, 1, p. 474–490 17 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile6 Downloads (Pure) -
ALDELE: all-purpose deep learning toolkits for predicting the biocatalytic activities of enzymes
Wang, X., Quinn, D., Moody, T. S. & Huang, M., 22 Apr 2024, In: Journal of Chemical Information and Modeling. 64, 8, p. 3123–3139 17 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile3 Citations (Scopus)41 Downloads (Pure) -
Artificial, biomimetic and hybrid enzymes: general discussion
Acevedo-Rocha, C., Bakshi, A., Bornscheuer, U. T., Campopiano, D. J., Civi´c, J., Drienovska, I., Ehinger, F. J., Gomm, A., Góra, A., Green, A. P., Hanzevacki, M., Harvey, J. N., Hilvert, D., Huang, M., Jarvis, A. G., Kamerlin, S. C. L., Lichtenstein, B. R., Luk, L. Y. P., Lutz, S. & Marsh, E. N. G. & 17 others, , 01 Sept 2024, In: Faraday Discussions. 252, p. 354-386 33 p.Research output: Contribution to journal › Comment/debate › peer-review
2 Citations (Scopus) -
Biocatalysis for industry, medicine and the circular economy: general discussion
Alogaidi, A., Armstrong, F., Bakshi, A., T. Bornscheuer, U., Brown, G., Bruton, I., J. Campopiano, D., Dourado, D., Johannes Ehinger, F., Flitsch, S., Gora, A., P. Green, A., Hilvert, D., Honda, S., Huang, M., E. H. Jones, R., King, T., R. Lichtenstein, B., Lihan, M. & Y. P. Luk, L. & 14 others, , 27 Aug 2024, In: Faraday Discussions. 252, p. 480-506Research output: Contribution to journal › Comment/debate › peer-review
1 Citation (Scopus) -
Experimental investigation and computational insights of enhanced rheological stability of water-based drilling fluids by microspherical polymers
Xu, L., Shen, J., Xu, M., Wu, S., Wang, X., Bao, Y., Huang, M., Yu, C. & Ding, Y., 04 Mar 2024, (Early online date) In: SPE Journal. 15 p., SPE-219469-PA.Research output: Contribution to journal › Article › peer-review
Open AccessFile44 Downloads (Pure)
Datasets
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BioStructNet: Structure-Based Network with Transfer Learning for Predicting Biocatalyst Functions
Huang, M. (Owner), Queen's University Belfast, Oct 2024
https://github.com/Xiangwen-Wang/BioStructNet
Dataset
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ALDELE: All-Purpose Deep Learning Toolkits for Predicting the Biocatalytic Activities of Enzymes
Huang, M. (Owner), Queen's University Belfast, Mar 2024
http://Github.com/Xiangwen-Wang/ALDELE
Dataset
Prizes
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Education Excellence Award
Huang, M. (Recipient), 10 May 2017
Prize: Prize (including medals and awards)
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Fellow of Royal Society of Biology (FRSB)
Huang, M. (Recipient), Jan 2022
Prize: Election to learned society
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Fellow of Royal Society of Chemistry (FRSC)
Huang, M. (Recipient), May 2021
Prize: Election to learned society
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Guest Research Fellowship awarded by Shanghai Jiaotong University
Huang, M. (Recipient), Jun 2012
Prize: National/international honour
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Innovation in Teaching Fund (VR lab)
Huang, M. (Recipient), Oct 2022
Prize: Prize (including medals and awards)
Activities
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LoCar's QUB-China 2nd Low Carbon Clean Energy Workshop
Huang, M. (Organiser)
26 Nov 2024 → 27 Nov 2024Activity: Participating in or organising an event types › Participation in workshop, seminar, course
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Environmental Science: Nano (Journal)
Huang, M. (Peer reviewer)
Nov 2024 → …Activity: Publication peer-review and editorial work types › Publication peer-review
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Nature Synthesis (Journal)
Huang, M. (Peer reviewer)
Nov 2024 → …Activity: Publication peer-review and editorial work types › Publication peer-review
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ACS Catalysis (Journal)
Huang, M. (Peer reviewer)
Oct 2024Activity: Publication peer-review and editorial work types › Publication peer-review
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Royal Society of Chemistry (Publisher)
Huang, M. (Book reviewer)
Oct 2024 → …Activity: Publication peer-review and editorial work types › Editorial activity
Press/Media
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£5m national supercomputer at Queen’s set to revolutionise research
11/11/2022
1 Media contribution
Press/Media: Research
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Queen’s scientists awarded significant funding to develop the enzymes of tomorrow
22/03/2021
1 Media contribution
Press/Media: Research
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New Biotechnology: Development of Computational and Molecular Biology Platforms for Almac and QUB
02/02/2015
1 Media contribution
Press/Media: Research