Chun Cai

发表

DeePKS+ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials

Linfeng Zhang, Han Wang, Mohan Chen, 2022, ArXiv.

DeePKS+ABACUS as a Bridge between Expensive Quantum Mechanical Models and Machine Learning Potentials

Linfeng Zhang, Han Wang, Mohan Chen, 2022, The journal of physical chemistry. A.

Uni-Dock: GPU-Accelerated Docking Enables Ultralarge Virtual Screening.

Zhengdan Zhu, Chun Cai, Zonghua Bo, 2023, Journal of chemical theory and computation.