Prediction of amino acid side chain conformation using a deep neural network. - Ke Liu; Xiangyan Sun; Jun Ma; Zhenyu Zhou; Qilin Dong; Shengwen Peng; Junqiu Wu; Suocheng Tan; Günter Blobel; Jie Fan 006 (CoRR, 2017)

Molecular modeling with machine-learned universal potential functions. - Ke Liu; Zekun Ni; Zhenyu Zhou; Suocheng Tan; Xun Zou; Haoming Xing; Xiangyan Sun; Qi Han; Junqiu Wu; Jie Fan 006 (CoRR, 2021)

ChemiRise: a data-driven retrosynthesis engine. - Xiangyan Sun; Ke Liu; Yuquan Lin; Lingjie Wu; Haoming Xing; Minghong Gao; Ji Liu; Suocheng Tan; Zekun Ni; Qi Han; Junqiu Wu; Jie Fan 006 (CoRR, 2021)