Biography
Shengli (Bruce) Jiang is a postdoctoral associate at Princeton University (supervisor: Michael A. Webb), focusing on integrating molecular simulation and machine learning for complex polymer design. He earned his Ph.D. from the University of Wisconsin-Madison (advisor: Victor M. Zavala), specializing in efficient and effective data representation methods. His doctoral research involved extensive collaboration with over 15 research groups on diverse chemical engineering challenges, including liquid crystal sensor design, mixed plastic waste classification, and chemical process monitoring.
He interned at Dow Inc. (2022, supervisors: Ivan Castillo and Zhenyu Wang), focusing on AI applications in industrial settings, and at Argonne National Laboratory (2020, supervisor: Prasanna Balaprakash), working on scalable AutoML and uncertainty quantification. He was also an undergraduate researcher at University of California, San Diego (advisor: Zheng Chen), working on polymer-based battery design. He is passionate about teaching and has mentored ten junior scholars. His current research interests include data-centric modeling, characterization, and design of complex materials (e.g., polymers and liquid crystals).
Email: sj0161@princeton.edu
Office: A326 EQuad, Princeton, NJ 08544
Research Interests
Molecular Modeling
Machine Learning
Materials Design
Education
PhD in Chemical Engineering, 2023
University of Wisconsin-Madison
BSc in Chemical Engineering, 2018
University of California, San Diego
Selected Publications
S. Jiang, A. B. Dieng, and M. A. Webb. Property-Guided Generation of Complex Polymer Topologies Using Variational Autoencoders. npj Computational Materials, 2024, 10, 139.
S. Jiang, S. Qin, R. C. Van Lehn, P. Balaprakash, and V. M. Zavala. Uncertainty Quantification for Molecular Property Predictions with Graph Neural Architecture Search. Digital Discovery (accepted), 2024.
S. Jiang, N. Bao, A. D. Smith, S. Byndoor, M. Mavrikakis, R. C. Van Lehn, N. L. Abbott and V. M. Zavala. Scalable Extraction of Information from Spatio-Temporal Patterns of Chemoresponsive Liquid Crystals Using Topological Data Analysis. Journal of Physical Chemistry C, 2023, 127, 32, 16081–16098.
N. Bao, S. Jiang, A. D. Smith, J. J. Schauer, M. Mavrikakis, R. C. Van Lehn, V. M. Zavala, and N. L. Abbott. Sensing Gas Mixtures by Analyzing the Spatiotemporal Optical Responses of Liquid Crystals using 3D Convolutional Neural Networks. ACS Sensors, 2022, 7, 9, 2545-2555.
S. Qin, S. Jiang, J. Li, P. Balaprakash, R. C. Van Lehn, and V. M. Zavala. Capturing Molecular Interactions in Graph Neural Networks: A Case Study in Multi-Component Phase Equilibrium. Digital Discovery, 2023, 2, 138.
S. Zinchik, S. Jiang, S. Friis, F. Long, L. Høgstedt, V. M. Zavala, and E. Bar-Ziv. Accurate Characterization of Mixed Plastic Waste using Machine Learning and Fast Infrared Spectroscopy. ACS Sustainable Chemistry & Engineering, 2021, 9, 42, 14143-14151.
S. Jiang, J. Noh, C. Park, A. D. Smith, N. L. Abbott, and V. M. Zavala. Endotoxin Detection Using Liquid Crystal Droplets and Machine Learning. Analyst, 2021, 146, 1224-1233.
A. K. Chew, S. Jiang, W. Zhang, V. M. Zavala, and R. C. Van Lehn. Fast Predictions of Liquid- Phase Acid-Catalyzed Reaction Rates Using Molecular Dynamics Simulations and Convolutional Neural Networks. Chemical Science, 2020, 11, 12464-12476.
Selected Presentations
Data Representations and Transformations in Chemical Engineering
Thesis Defense
May 1, 2023 ⋅ Madison, WI
Real-Time Characterization of Mixed Plastic Waste Using Machine Learning and Infrared Spectroscopy
FOCAPO/CPC 2023
Jan 8 - Jan 12, 2023 ⋅ San Antonio, TX
Characterization of Chemoresponsive Liquid Crystals Using Topological Descriptors and Machine Learning
AIChE Annual Meeting 2022
Nov 13 - Nov 18, 2022 ⋅ Phoenix, AZ
Molecular Property Uncertainty Quantification Using Automatic Graph Neural Architecture Search
AIChE Annual Meeting 2022
Nov 13 - Nov 18, 2022 ⋅ Phoenix, AZ
Rapid and Real-Time Mixed-Plastic Waste Analysis Using Infrared Spectroscopy and Machine Learning
AIChE Annual Meeting 2021
Nov 7 - Nov 11, 2022 ⋅ Boston, MA