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29 Jul 2026
SERC
Institute of Sustainability for Chemicals, Energy and Environment
High‐Throughput Screening of Flavan‐3‐Ol Antioxidants Through DFT‐Guided Machine Learning
(Pending publish)
Zicong Marvin Wong,
Ying Sin Koo,
Yee Hwee Lim,
Dillon W. P. Tay,
Shi Jun Ang
International Journal of Quantum Chemistry
30 Apr 2026
SERC
Institute of Sustainability for Chemicals, Energy and Environment
Accelerating natural product discovery with linked MS-genomics and language/transformer-based models
Dillon Tay,
Winston Koh,
Shi Jun Ang,
Marvin Wong,
Yi Wee Lim,
Elena Heng,
Yu Hung Ng,
Naythan Yeo,
Krishnan Adaikkappan,
Fong Tian Wong,
Yee Hwee Lim
npj antimicrobials and resistance
14 Apr 2026
SERC
Institute of Materials Research and Engineering
Modulating Electrochromic Properties via Thiophene Donors in Thieno[3,4-c]pyrrole-4,6-dione-based Conjugated Polymers
Kok Chan Chong,
Kang Le Osmund Chin,
Shi Jun Ang,
Ran Tao,
Jianwei Xu,
Ming Hui Chua
Journal of Materials Chemistry C
23 Sep 2024
SERC
Institute of Sustainability for Chemicals, Energy and Environment
Composite Machine Learning Strategy for Natural Products Taxonomical Classification and Structural Insights
Qisong Xu,
Alan K. X. Tan,
Liangfeng Guo,
Yee Hwee Lim,
Dillon W. P. Tay,
Shi Jun Ang
Digital Discovery
19 May 2023
SERC
Institute of Sustainability for Chemicals, Energy and Environment
67 million natural product-like compound database generated via molecular language processing
Dillon W. P. Tay,
Naythan Z. X. Yeo,
Krishnan Adaikkappan,
Yee Hwee Lim,
Shi Jun Ang
Scientific Data
11 Nov 2022
SERC
Institute of Sustainability for Chemicals, Energy and Environment
Pyrrolo[3,4-c]pyridine-1,2-dione: a new electron acceptor for electrochromic conjugated polymers
Tung Phuc Vo,
Ming Hui Chua,
Shi Jun Ang,
Kang Le Osmund Chin,
Xiang Yun Debbie Soo,
Zhuang Mao Png,
Teck Lip Dexter Tam,
Qiang Zhu,
David John Procter,
Jianwei Xu
Polymer Chemistry
19 Aug 2022
SERC
Institute of Sustainability for Chemicals, Energy and Environment
Aggregation Induced Emission (AIE)‐Active Poly(acrylates) for Electrofluorochromic Detection of Nitroaromatic Compounds
Ming Hui Chua,
Kang Le Osmund Chin,
Shi Jun Ang,
Xiang Yun Debbie Soo,
Zhuang Mao Png,
Qiang Zhu,
Jianwei Xu
ChemPhotoChem
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