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A Process Calculus for Design and Modeling of Retro-Synthesis

机译:复古合成设计与建模的过程结石

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We describe a logical calculus for process synthesis applying reaction rules for consuming, transforming and producing products at costs. Unlike common logical calculi, which deal with propositions supported by truth semantics, the process synthesis calculus deals with products (in a concrete or abstract sense) and their costs, and creation of products by the composing of appropriate reaction assemblies from a database of reactions or transactions. As such the calculus may be understood as a resource logic akin to linear logics. The calculus appeals to means-end backwards reasoning using a derivative of definite clause logic. Although rather general in scope, as an interesting case in this paper the calculus is applied to chemical retro-synthesis - in particular with the notoriously difficult Solvay cluster designs.
机译:我们描述了工艺合成的逻辑微积分,适用反应规则以以成本为消费,转化和生产产品。与常见的逻辑计算不同,这与真理语义支持的主张不同,过程合成演算涉及产品(具体或抽象意义)及其成本,并通过组成来自反应数据库的适当反应组件的产品或创建产品交易。因此,计算可以被理解为类似于线性逻辑的资源逻辑。使用明确条款逻辑的衍生物,微积分呼吁介绍倒退推理。虽然范围相当一般,作为本文的有趣案例,微积分应用于化学复古合成 - 特别是臭名昭着的难度簇设计。

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