结构化学
  ISSN 0254-5861  CN35-1112/TQ  
 
结构化学  2019, Vol. 38 Issue (11): 1845-1856    
  theoretical chemistry 本期目录 | 过刊浏览 | 高级检索 |
基于晶体结构、密度泛函理论计算和分子对接技术的两种芳基吡唑衍生物杀菌效果比较
刘媛媛;李壹;吕坤志
a (School of Pharmaceutical and Chemical Engineering,Chengxian College, Southeast University, Nanjing 210088, China)
b (College of Food Science and Light Industry,Nanjing Technical University, Nanjing 211816, China)
c (Nanjing Sanhome Pharmaceutical Co Ltd., Nanjing 210018, China)
Comparison of Fungicidal Difference of Two Arylpyrazoles Based on the Crystal Structures, Density Functional Theory Calculation and Molecular Docking
LIU Yuan-Yuan;LI Yi;LV Kun-Zhi
a (School of Pharmaceutical and Chemical Engineering,Chengxian College, Southeast University, Nanjing 210088, China)
b (College of Food Science and Light Industry,Nanjing Technical University, Nanjing 211816, China)
c (Nanjing Sanhome Pharmaceutical Co Ltd., Nanjing 210018, China)
 
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