GALAMOST: GPU-accelerated large-scale molecular simulation toolkit. - You-Liang Zhu; Hong Liu 014; Zhan-Wei Li; Hu-Jun Qian; Giuseppe Milano; Zhong-Yuan Lu (J. Comput. Chem., 2013)

A kinetic chain growth algorithm in coarse-grained simulations. - Hong Liu 014; You-Liang Zhu; Zhong-Yuan Lu; Florian Müller-Plathe (J. Comput. Chem., 2016)

The ENUF method - Ewald summation based on nonuniform fast Fourier transform: Implementation, parallelization, and application. - Sheng-Chun Yang; Bin Li 069; You-Liang Zhu; Aatto Laaksonen; Yong-Lei Wang (J. Comput. Chem., 2020)