cross validation

How Can Cross Validation Improve Catalyst Design?

Cross validation can significantly enhance catalyst design by:
- Screening potential catalysts: It helps in screening and ranking potential catalysts based on their performance across different subsets of data.
- Optimizing reaction conditions: By validating different reaction conditions, cross validation aids in optimizing parameters such as temperature, pressure, and concentration.
- Predicting catalyst activity: It allows for more accurate predictions of catalyst activity and stability, leading to better-designed catalysts.

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