Extrapolative Bayesian optimization with Gaussian process and neural network ensemble surrogate models by Lim, Yee-Fun, Ng, Chee Koon, Vaitesswar, U. S., Hippalgaonkar, Kedar

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Mapping pareto fronts for efficient multi-objective materials discovery by Low, Andre Kai Yuan, Vissol-Gaudin, Eleonore, Lim, Yee-Fun, Hippalgaonkar, Kedar

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Experimentally validated inverse design of multi-property Fe-Co-Ni alloys by Padhy, Shakti P., Chaudhary, Varun, Lim, Yee-Fun, Zhu, Ruiming, Thway, Muang, Hippalgaonkar, Kedar, Ramanujan, Raju V.

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Transfer learning of full molecular weight distributions via high-throughput computer-controlled polymerization by Tan, Jin Da, Ramalingam, Balamurugan, Wong, Swee Liang, Cheng, Jayce Jian Wei, Lim, Yee-Fun, Chellappan, Vijila, Khan, Saif A., Kumar, Jatin, Hippalgaonkar, Kedar

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Evolution-guided Bayesian optimization for constrained multi-objective optimization in self-driving labs by Low, Andre Kai Yuan, Mekki-Berrada, Flore, Gupta, Abhishek, Ostudin, Aleksandr, Xie, Jiaxun, Vissol-Gaudin, Eleonore, Lim, Yee-Fun, Li, Qianxiao, Ong, Yew Soon, Khan, Saif A., Hippalgaonkar, Kedar

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Machine-learning-assisted discovery of mechanosynthesized lead-free metal halide perovskites for the oxidative photocatalytic cleavage of alkenes by Xiao, Yonghao, Choudhuri, Khokan, Thanetchaiyakup, Adisak, Chan, Wei Xin, Hu, Xinwen, Sadek, Mansour, Tam, Ying Hern, Loh, Ryan Guanying, Sharifah Nadhirah Binte Shaik Mohammed, Lim, Kendric Jian Ying, Ten, Ju Zheng, Garcia, Felipe, Chellappan, Vijila, Choksi, Tej S., Lim, Yee‐Fun, Soo, Han Sen

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An object-oriented framework to enable workflow evolution across materials acceleration platforms by Leong, Chang Jie, Low, Andre Kai Yuan, Recatala-Gomez, Jose, Velasco, Pablo Quijano, Vissol-Gaudin, Eleonore, Tan, Jin Da, Ramalingam, Balamurugan, Made, Riko I, Pethe, Shreyas Dinesh, Sebastian, Saumya, Lim, Yee-Fun, Khoo, Jonathan Zi Hui, Bai, Yang, Cheng, Jayce Jian Wei, Hippalgaonkar, Kedar

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Multi‐Fidelity High‐Throughput Optimization of Electrical Conductivity in P3HT‐CNT Composites by Bash, Daniil, Cai, Yongqiang, Chellappan, Vijila, Wong, Swee Liang, Yang, Xu, Kumar, Pawan, Tan, Jin Da, Abutaha, Anas, Cheng, Jayce JW, Lim, Yee‐Fun, Tian, Siyu Isaac Parker, Ren, Zekun, Mekki‐Berrada, Flore, Wong, Wai Kuan, Xie, Jiaxun, Kumar, Jatin, Khan, Saif A, Li, Qianxao, Buonassisi, Tonio, Hippalgaonkar, Kedar

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Surface charge as activity descriptors for electrochemical CO₂ reduction to multi-carbon products on organic-functionalised Cu by Lim, Carina Yi Jing, Yilmaz, Meltem, Arce-Ramos, Juan Manuel, Handoko, Albertus D., Teh, Wei Jie, Zheng, Yuangang, Khoo, Jonathan Zi Hui, Lin, Ming, Isaacs, Mark, Tam, Dexter Teck Lip, Bai, Yang, Ng, Chee Koon, Yeo, Boon Siang, Sankar, Gopinathan, Parkin, Ivan P., Hippalgaonkar, Kedar, Sullivan, Michael B., Zhang, Jia, Lim, Yee-Fun

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