Map
This action assigns map numbers to atoms of a molecule or a reaction. Map numbers are assigned in a given order to each atom of the input structure.
Options in case of reaction file input:
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Select the mapping style as Complete, Matching, or Changing.
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Map action can also Mark bonds that have changed in the reaction.
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Keep existing mapping (on by default)
Note : Reactions are mapped by the AutoMapper User's Guide tool.
Example :
Action |
Input |
Output |
Map |
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|
Map |
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