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Updated: Jan 30, 2026

Predicting Catalyst Extrudate Breakage Based on the Modulus of Rupture
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Predicting Catalyst Extrudate Breakage Based on the Modulus of Rupture

Published on: May 13, 2018

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通过计算机驱动的工作流程和机器学习预测高选择性催化剂

Andrew F Zahrt1, Jeremy J Henle1, Brennan T Rose1

  • 1Roger Adams Laboratory, Department of Chemistry, University of Illinois, Urbana, IL 61801, USA.

Science (New York, N.Y.)
|January 19, 2019
PubMed
概括

这项研究引入了选择性催化剂的计算方法,加速了不对称的反应. 机器学习模型可以准确预测催化剂的选择性,从而提高化学合成的效率.

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