Reactor in Pipeline Pilot

Virtual reaction processing

  • Supports smart reaction rules to produce synthetically feasible products

  • Sequential or combinatorial mode

  • Product or reaction output

  • Select products to include in output

  • Use tagger components to distinguish inputs of multi-reactant reactions

  • Synthesis code generation

  • Output reaction mapping

  • Advanced options:

– Unambiguous only

– Ignore rules:

  • Reactivity and Exclude

  • Selectivity

  • Tolerance

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Combinatorial Reactor Example

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More on Pipeline Pilot integration

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