Runhan Shi

According to our database, Runhan Shi authored at least 7 papers between 2022 and 2026.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2026

Learning Molecular Chirality via Chiral Determinant Kernels.

Runhan Shi, Zhicheng Zhang, Letian Chen, Gufeng Yu, Yang Yang

CoRR, February, 2026

RTMol: Rethinking Molecule-text Alignment in a Round-trip View.

Letian Chen, Runhan Shi, Gufeng Yu, Yang Yang

Proceedings of the Fortieth AAAI Conference on Artificial Intelligence, 2026

2025

Machine Learning for Reaction Performance Prediction in Allylic Substitution Enhanced by Automatic Extraction of a Substrate-Aware Descriptor.

Gufeng Yu, Xi Wang, Yichong Luo, Guanlin Li, Rui Ding, Runhan Shi, Xiaohong Huo, Yang Yang

J. Chem. Inf. Model., 2025

Reaction Prediction via Interaction Modeling of Symmetric Difference Shingle Sets.

Runhan Shi, Letian Chen, Gufeng Yu, Yang Yang

Proceedings of the Advances in Neural Information Processing Systems 38: Annual Conference on Neural Information Processing Systems 2025, 2025

2024

Prediction of chemical reaction yields with large-scale multi-view pre-training.

Runhan Shi, Gufeng Yu, Xiaohong Huo, Yang Yang

J. Cheminformatics, December, 2024

BatGPT-Chem: A Foundation Large Model For Retrosynthesis Prediction.

Yifei Yang, Runhan Shi, Zuchao Li, Shu Jiang, Bao-Liang Lu, Yang Yang, Hai Zhao

CoRR, 2024

2022

ReLMole: Molecular Representation Learning Based on Two-Level Graph Similarities.

Zewei Ji, Runhan Shi, Jiarui Lu, Fang Li, Yang Yang

J. Chem. Inf. Model., 2022