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Shi Jun Ang

Senior Scientist

Institute of High Performance Computing

Singapore

Research Interests

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Professors in Pharmaceutical Chemistry

Articles (9)

Year:

2026

Year:

2026

Year:

2026

Year:

2026

Year:

2025

Year:

2024

Year:

2024

Year:

2023

Year:

2023

Collaborators (3)

Ming Wah Wong

Full Professor

National University of Singapore (NUS)

SINGAPORE

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Ming Hui Chua

Senior Scientist

Agency for Science, Technology and Research (A*STAR)

SINGAPORE

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Utkur Mirsaidov

Assistant Professor

National University of Singapore (NUS)

SINGAPORE

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Shi Jun Ang

Research Interests

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Articles (9)

Accelerating Primary Screening of USP8 Inhibitors from Drug Repurposing Databases with Tree‐Based Machine Learning

High‐Throughput Screening of Flavan‐3‐Ol Antioxidants Through DFT‐Guided Machine Learning

How Do Initial Spins Affect Density Functional Theory Convergence for Magnetic High Entropy Alloys?

Modulating electrochromic properties via thiophene donors in thieno[3,4-c]pyrrole-4,6-dione-based conjugated polymers

Accelerated and efficient modeling of low-κ organosilicate glass with the M3GNet machine learning interatomic potentials

Composite machine learning strategy for natural products taxonomical classification and structural insights

Enhancing the photocatalytic upcycling of polystyrene to benzoic acid: a combined computational-experimental approach for acridinium catalyst design

Dynamics of the fcc-to-bcc phase transition in single-crystalline PdCu alloy nanoparticles

67 million natural product-like compound database generated via molecular language processing

Collaborators (3)

Ming Wah Wong

Ming Hui Chua

Utkur Mirsaidov

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