AUTHOR=Xie Dong , Tian Yongzheng , Cao Li , Guo Penghang , Cai Zhibiao , Zhou Jie TITLE=3D-QSAR, design, molecular docking and dynamics simulation studies of novel 6-hydroxybenzothiazole-2-carboxamides as potentially potent and selective monoamine oxidase B inhibitors JOURNAL=Frontiers in Pharmacology VOLUME=16 YEAR=2025 URL=https://www.frontiersin.org/journals/pharmacology/articles/10.3389/fphar.2025.1545791 DOI=10.3389/fphar.2025.1545791 ISSN=1663-9812