MooSeeker: A Metabolic Pathway Design Tool Based on Multi-Objective Optimization Algorithm. - Yahui Cao; Tao Zhang 025; Xin Zhao 006; Xue Jia 002; Bingzhi Li (IEEE ACM Trans. Comput. Biol. Bioinform., 2023)

A Supervised Surrogate-Assisted Evolutionary Algorithm for Complex Optimization Problems. - Xin Zhao 006; Xue Jia 002; Tao Zhang 025; Tianwei Liu; Yahui Cao (IEEE Trans. Instrum. Meas., 2023)

Evolutionary Algorithms With Blind Fitness Evaluation for Solving Optimization Problems With Only Fuzzy Fitness Information. - Xin Zhao 006; Xue Jia 002; Tao Zhang 025; Yahui Cao; Tianwei Liu (IEEE Trans. Fuzzy Syst., 2023)

A Multiple Environmental Parameters and Molecular Fingerprints Contribution model for prediction of Gibbs free energy. - Xin Zhao 006; Kang Li; Tao Zhang 025; Shuxin Cui; Yahui Cao; Xue Jia 002 (Comput. Biol. Chem., 2025)

Materials Map Integrating Experimental and Computational Data through Graph-Based Machine Learning for Enhanced Materials Discovery. - Yusuke Hashimoto; Xue Jia 002; Hao Li; Takaaki Tomai (CoRR, 2025)

"DIVE" into Hydrogen Storage Materials Discovery with AI Agents. - Di Zhang; Xue Jia 002; Tran Ba Hung; Seong Hoon Jang; Linda Zhang 006; Ryuhei Sato; Yusuke Hashimoto; Toyoto Sato; Kiyoe Konno; Shin-ichi Orimo; Hao Li (CoRR, 2025)