监管与产业动态· Rapid communications in mass spectrometry : RCM·· 8 小时前评分30
颈通颗粒质控标志物预测靶向神经根型颈椎病上调的中性粒细胞颗粒酶：整合机器学习与分子动力学研究
Mass-Spectrometry-Identified Quality Markers of Jingtong Granules Are Predicted to Engage Upregulated Neutrophil Granule Enzymes in Cervical Spondylotic Radiculopathy: An Integrative Machine-Learning and Molecular-Dynamics Study
导读
颈通颗粒质控标志物 nodakenin 与 paeoniflorin 经分子对接和动力学模拟可结合于 CSR 患者上调的中性粒细胞颗粒酶 ELANE 与 CTSG 催化口袋，MM-GBSA 结合自由能为 -16.0 至 -33.5 kcal/mol。
来源：监管与产业动态 · doi.org