Publications

(2023). Scalable Extraction of Information from Spatio-Temporal Patterns of Chemoresponsive Liquid Crystals Using Topological Data Analysis. ChemRxiv preprint ChemRxiv:2023-fjcxd-v2.

PDF Cite Code

(2022). Capturing molecular interactions in graph neural networks: a case study in multi-component phase equilibrium. Digital Discovery, 2.1 (2023): 138-151.

PDF Cite Code

(2022). Online Characterization of Mixed Plastic Waste Using Machine Learning and Mid-Infrared Spectroscopy. ACS Sustainable Chemistry & Engineering 10.48 (2022): 16064-16069.

PDF Cite Code

(2022). Convolutional Neural Networks: Basic Concepts and Applications in Manufacturing. arXiv preprint arXiv:2210.07848.

PDF Cite

(2022). Sensing Gas Mixtures by Analyzing the Spatiotemporal Optical Responses of Liquid Crystals Using 3D Convolutional Neural Networks. ACS Sensors 7.9 (2022): 2545-2555.

PDF Cite

(2021). Accurate Characterization of Mixed Plastic Waste Using Machine Learning and Fast Infrared Spectroscopy. ACS Sustainable Chemistry & Engineering 9.42 (2021): 14143-14151.

PDF Cite Code

(2021). Using ATR-FTIR spectra and convolutional neural networks for characterizing mixed plastic waste. Computers & Chemical Engineering 155 (2021): 107547.

PDF Cite Code

(2021). Convolutional neural nets in chemical engineering: Foundations, computations, and applications. AIChE Journal 67.9 (2021): e17282.

PDF Cite Code

(2020). Graph neural network architecture search for molecular property prediction. 2020 IEEE International conference on big data (big data). IEEE, 2020.

PDF Cite Code

(2020). Using machine learning and liquid crystal droplets to identify and quantify endotoxins from different bacterial species. Analyst 146.4 (2021): 1224-1233.

PDF Cite

(2020). Fast predictions of liquid-phase acid-catalyzed reaction rates using molecular dynamics simulations and convolutional neural networks. Chemical science 11.46 (2020): 12464-12476.

PDF Cite Code

(2018). Highly compact, free-standing porous electrodes from polymer-derived nanoporous carbons for efficient electrochemical capacitive deionization. Journal of Materials Chemistry A 7.4 (2019): 1768-1778.

PDF Cite

(2018). Scalable synthesis of uniform nanosized microporous carbon particles from rigid polymers for rapid ion and molecule adsorption. ACS applied materials & interfaces 10.30 (2018): 25429-25437.

PDF Cite

(2018). Understanding the electrochemical properties of naphthalene diimide: implication for stable and high-rate lithium-ion battery electrodes. Chemistry of Materials 30.10 (2018): 3508-3517.

PDF Cite