Showing cs.LGShow all
2 papers · 1 filter
cs.LG2025
Molecule Graph Networks with Many-body Equivariant Interactions
Zetian Mao, Chuan-Shen Hu, Jiawen Li +5
Message passing neural networks have demonstrated significant efficacy in predicting molecular interactions. Introducing equivariant vectorial representations augments expressivity…
cs.LG2024
Preference-Optimized Pareto Set Learning for Blackbox Optimization
Zhang Haishan, Diptesh Das, Koji Tsuda
Multi-Objective Optimization (MOO) is an important problem in real-world applications. However, for a non-trivial problem, no single solution exists that can optimize all the objec…