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What Role Do Simulations Play in Catalysis Research?

[Simulation] techniques are crucial in catalysis research. They allow scientists to create virtual models of catalytic processes, enabling the testing of various conditions without the need for costly and time-consuming experiments. These simulations can identify the most effective catalysts, optimal reaction conditions, and potential side reactions. By using game-based simulations, researchers can visualize and manipulate complex catalytic networks, leading to better understanding and innovation.

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