Development of human lactate dehydrogenase a inhibitors: high-throughput screening, molecular dynamics simulation and enzyme activity assay. - Yuanyuan Shu; Jianda Yue; Yaqi Li; Yekui Yin; Jiaxu Wang; Tingting Li; Xiao He; Songping Liang; Gaihua Zhang; Zhonghua Liu; Ying Wang (J. Comput. Aided Mol. Des., 2024)