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Methods and apparatus for in silico prediction of chemical reactions
Methods and apparatus for in silico prediction of chemical reactions
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机译:计算机模拟化学反应的方法和装置
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摘要
Provided are a method and apparatus for designing and processing a rule pipeline for in silico prediction of chemical reactions. The method includes designing a rule pipeline from at least one rule for chemical conversion and processing at least one input molecule by using the designed rule pipeline to predict a chemical reaction based on a processing result of the processing.
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