Half Reaction Generator¶
Category Paths
Follow one of these paths in the Orion user interface, to find the floe.
Role-based/Cheminformatician/Medicinal Chemistry Support
Description
Generates half-reactions for reactions specified in an input reaction definition file
Promoted Parameters
Title in user interface (promoted name)
Inputs
Reaction Definition (rxndef): The name of a file resource containing the reaction definitions
Required
Type: file_in
Outputs
Reaction Definition Output (rxndefout): An optional file resource name to capture the updated reaction definition file output
Type: file_out
Generation Options
Generation Mode (genmode):
Requested mode for generating half-reactions, e.g.: All, Unspecified. ‘Unspecified’ will attempt to automatically generate half-reactions for any reactions that do not already have explicitly provided versions, and ‘All’ will regenerate all of the half-reactions, regardless of existing specifications in the reaction definition file.
Type: string
Default: Unspecified
Choices: [‘All’, ‘Unspecified’]