Dynamic Mechanism of a Fluorinated Oxime Reactivator Unbinding from AChE Gorge in Polarizable Water

2018 ◽  
Vol 122 (14) ◽  
pp. 3876-3888 ◽  
Author(s):  
Arup K. Pathak ◽  
Tusar Bandyopadhyay
Author(s):  
Shan Du ◽  
Xin-hua Lu ◽  
Wei-Ya Li ◽  
Li-Peng Li ◽  
Yang-Chun Ma ◽  
...  
Keyword(s):  

Processes ◽  
2021 ◽  
Vol 9 (2) ◽  
pp. 229
Author(s):  
Wende Tian ◽  
Shifa Zhang ◽  
Zhe Cui ◽  
Zijian Liu ◽  
Shaochen Wang ◽  
...  

Due to the complexity of materials and energy cycles, the distillation system has numerous working conditions difficult to troubleshoot in time. To address the problem, a novel DMA-SDG fault identification method that combines dynamic mechanism analysis based on process simulation and signed directed graph is proposed for the distillation process. Firstly, dynamic simulation is employed to build a mechanism model to provide the potential relationships between variables. Secondly, sensitivity analysis and dynamic mechanism analysis in process simulation are introduced to the SDG model to improve the completeness of this model based on expert knowledge. Finally, a quantitative analysis based on complex network theory is used to select the most important nodes in SDG model for identifying the severe malfunctions. The application of DMA-SDG method in a benzene-toluene-xylene (BTX) hydrogenation prefractionation system shows sound fault identification performance.


2021 ◽  
Author(s):  
Raphael Böhm ◽  
Stefan Imseng ◽  
Roman P. Jakob ◽  
Michael N. Hall ◽  
Timm Maier ◽  
...  
Keyword(s):  

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