Combining network pharmacology, machine learning, molecular docking and molecular dynamic to explore the mechanism of Chufeng Qingpi decoction in treating schistosomiasis

• DOI: 10.3389/fcimb.2024.1453529
• Publication Date: 2024-09-06T08:36:49Z
• Authors: Minglu Liu; Yuxin Wang; Wen Deng; Jiahao Xie; Yanyao He; Liang Wang; Jianbin Zhang; Ming Cui
• Keywords: Decoction; Docking (animal)

Although the Chufeng Qingpi Decoction (CQD) has demonstrated clinical effectiveness in treatment of schistosomiasis, precise active components and underlying mechanisms its therapeutic action remain elusive. To achieve a profound comprehension, we incorporate network pharmacology, bioinformatics analysis, molecular docking, dynamics simulations as investigative methodologies within our research framework.