Fragment and Geometry Aware Tokenization of Molecules for Structure-Based Drug Design Using Language Models. - Cong Fu 003; Xiner Li; Blake Olson; Heng Ji 001; Shuiwang Ji (ICLR, 2025)

Inference-Time Computations for LLM Reasoning and Planning: A Benchmark and Insights. - Shubham Parashar; Blake Olson; Sambhav Khurana; Eric Li; Hongyi Ling; James Caverlee; Shuiwang Ji (CoRR, 2025)

Complex LLM Planning via Automated Heuristics Discovery. - Hongyi Ling; Shubham Parashar; Sambhav Khurana; Blake Olson; Anwesha Basu; Gaurangi Sinha; Zhengzhong Tu; James Caverlee; Shuiwang Ji (CoRR, 2025)

Curriculum Reinforcement Learning from Easy to Hard Tasks Improves LLM Reasoning. - Shubham Parashar; Shurui Gui; Xiner Li; Hongyi Ling; Sushil Vemuri; Blake Olson; Eric Li; Yu Zhang 044; James Caverlee; Dileep Kalathil; Shuiwang Ji (CoRR, 2025)