1. 毕业设计（论文）的内容和要求

(1) 通过查阅文献，了解该课题的国内外研究现状；

(2) 学习和掌握有关计算软件的使用；

(3) 乙酰胆碱酯酶ache与抑制剂小分子（1,7-二氮杂咔唑抑制剂）为研究体系，利用模拟软件对该体系进行模拟计算，分析体系在溶剂中的构象变化以及ache与抑制剂的作用机理；

2. 参考文献

[1] delogu, g.l.; matos, m.j.; fanti, m.; era, b.; medda, r.; pieroni, e., 2-phenylbenzofuran derivatives as butyrylcholinesterase inhibitors: synthesis, biological activity and molecular modeling. bioorganic amp; medicinal chemistry letters. 2016, 26, 2308-2313.

[2] zhu, x.l.; yu, n.x.; hao, g.f.; yang, w.c.; yang, g.f., structural basis of femtomolar inhibitors for acetylcholinesterase subtype selectivity: insights from computational simulations. j mol graph model. 2013, 41, 55-60.

[3] zhang, c.; du, q.y.; chen, l.d.; wu, w.h.; liao, s.y.; yu, l.h., design, synthesis and evaluation of novel tacrine-multialkoxybenzene hybrids as multi-targeted compounds against alzheimer's disease. european journal of medicinal chemistry. 2016, 116, 200-209.

3. 毕业设计（论文）进程安排