Cov_FB3D: A De Novo Covalent Drug Design Protocol Integrating the BA-SAMP Strategy and Machine-Learning-Based Synthetic Tractability Evaluation. - Lin Wei; Wuqiang Wen; Li Rao 001; Yunyuan Huang; Mengting Lei; Kai Liu; Saiya Hu; Rongrong Song; Yanliang Ren; Jian Wan 004 (J. Chem. Inf. Model., 2020)

Rapid Repurposing of Novel Combination Drugs for the Treatment of Heart Failure via a Computationally Guided Network Screening Approach. - Yunyuan Huang; Jiqun Wang; Jiaqi Liu; Donglei Shi; Xiaokang Li; Manjiong Wang; Taotao Lu; Bei Jiang; Conglong Xia; Houwen Lin; Yixiang Xu; Jian Li (J. Chem. Inf. Model., 2022)

Novel Combination Therapy for Heart Failure: Trimebutine-Methoxsalen Identified through Synergistic Network Virtual Screening and Experimental Validation. - Yunyuan Huang; Xin Chen; Jin Yang; Yue Yao; Manjiong Wang; Taotao Lu; Xiao Li; Jiqun Wang; Sicong Qiao; Donglei Shi; Xiaokang Li; Jian Li; et al. (J. Chem. Inf. Model., 2024)