Approach for Discovery and Optimisation of New Catalysts

2 Information-guided Approach for Discovery and Optimisation of New Catalysts 

This second approach is based on pre-existing knowledge of catalysis with the assistance of design of experiment (DoE) tools for library design and performance 

A slightly distinct strategy, referred to here as Strategy WGS 2 , consists of two steps (Fig. 10.4)  

3 Knowledge Acquisition from Data Analysis Mechanistic and Kinetic Insights for a Given Set of Reactions 

This third strategy aims at designing HT data acquisition procedure in such a way that more advanced information is collected, such as mechanistic and kinetic insights, as compared with the limited information obtained with the previous strategies. This newly acquired knowledge can be used in turn for further combinatorial strategies, as above described (ES or DoE) [12]. 

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Information-guided approach for discovery and optimisation of new catalysts. 

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