8 papers
NRCD: An Open Database of Collegiate Running with Unified Performance Standardization
Jonathan A. Karr, Ryan M. Fryer, Ben Darden +5
Collegiate running in the United States generates thousands of race results annually in cross country and track and field, yet no large-scale dataset has been publicly available fo…
ReactionTeam: Teaming Experts for Divergent Thinking Beyond Typical Reaction Patterns
Taicheng Guo, Changsheng Ma, Xiuying Chen +6
Reaction prediction, a critical task in synthetic chemistry, is to predict the outcome of a reaction based on given reactants. Generative models like Transformer have typically bee…
Node Duplication Improves Cold-start Link Prediction
Zhichun Guo, Tong Zhao, Yozen Liu +5
Graph Neural Networks (GNNs) are prominent in graph machine learning and have shown state-of-the-art performance in Link Prediction (LP) tasks. Nonetheless, recent studies show tha…
MetaLLM: A High-performant and Cost-efficient Dynamic Framework for Wrapping LLMs
Quang H. Nguyen, Thinh Dao, Duy C. Hoang +4
The rapid progress in machine learning (ML) has brought forth many large language models (LLMs) that excel in various tasks and areas. These LLMs come with different abilities and…
Are we making much progress? Revisiting chemical reaction yield prediction from an imbalanced regression perspective
Yihong Ma, Xiaobao Huang, Bozhao Nan +4
The yield of a chemical reaction quantifies the percentage of the target product formed in relation to the reactants consumed during the chemical reaction. Accurate yield predictio…
HetGPT: Harnessing the Power of Prompt Tuning in Pre-Trained Heterogeneous Graph Neural Networks
Yihong Ma, Ning Yan, Jiayu Li +2
Graphs have emerged as a natural choice to represent and analyze the intricate patterns and rich information of the Web, enabling applications such as online page classification an…