Yunchao Liu

According to our database, Yunchao Liu authored at least 10 papers between 2020 and 2025.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of three.

2025

SuperMetal: a generative AI framework for rapid and precise metal ion location prediction in proteins.

Xiaobo Lin, Zhaoqian Su, Yunchao Liu, Jingxian Liu, Xiaohan Kuang, Peter T. Cummings, Jesse Spencer-Smith, Jens Meiler

J. Cheminformatics, December, 2025

Amplifying Your Social Media Presence: Personalized Influential Content Generation with LLMs.

Yuying Zhao, Yu Wang, Xueqi Cheng, Anne M. Tumlin, Yunchao Liu, Damin Xia, Meng Jiang, Tyler Derr

CoRR, May, 2025

Fairness and Diversity in Recommender Systems: A Survey.

Yuying Zhao, Yu Wang, Yunchao Liu, Xueqi Cheng, Charu C. Aggarwal, Tyler Derr

ACM Trans. Intell. Syst. Technol., February, 2025

Advancements in Ligand-Based Virtual Screening through the Synergistic Integration of Graph Neural Networks and Expert-Crafted Descriptors.

Yunchao Liu, Rocco Moretti, Yu Wang, Ha Dong, Bailu Yan, Bobby Bodenheimer, Tyler Derr, Jens Meiler

J. Chem. Inf. Model., 2025

Edge Classification on Graphs: New Directions in Topological Imbalance.

Xueqi Cheng, Yu Wang, Yunchao Liu, Yuying Zhao, Charu C. Aggarwal, Tyler Derr

Proceedings of the Eighteenth ACM International Conference on Web Search and Data Mining, 2025

2024

Machine-learning-based structural analysis of interactions between antibodies and antigens.

Grace Zhang, Xiaohan Kuang, Yuhao Zhang, Yunchao Liu, Zhaoqian Su, Tom Zhang, Yinghao Wu

Biosyst., 2024

WelQrate: Defining the Gold Standard in Small Molecule Drug Discovery Benchmarking.

Yunchao Liu, Ha Dong, Xin Wang, Rocco Moretti, Yu Wang, Zhaoqian Su, Jiawei Gu, Bobby Bodenheimer, Charles David Weaver, Jens Meiler, Tyler Derr

Proceedings of the Advances in Neural Information Processing Systems 38: Annual Conference on Neural Information Processing Systems 2024, 2024

A Topological Perspective on Demystifying GNN-Based Link Prediction Performance.

Yu Wang, Tong Zhao, Yuying Zhao, Yunchao Liu, Xueqi Cheng, Neil Shah, Tyler Derr

Proceedings of the Twelfth International Conference on Learning Representations, 2024

2023

Interpretable Chirality-Aware Graph Neural Network for Quantitative Structure Activity Relationship Modeling in Drug Discovery.

Yunchao Liu, Yu Wang, Oanh Vu, Rocco Moretti, Bobby Bodenheimer, Jens Meiler, Tyler Derr

Proceedings of the Thirty-Seventh AAAI Conference on Artificial Intelligence, 2023

2020

Foldit Drug Design Game Usability Study: Comparison of Citizen and Expert Scientists.

Yunchao Liu, Rocco Moretti, Bobby Bodenheimer, Jens Meiler

Proceedings of the MIG '20: Motion, 2020