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:
Select the mapping style as Complete , Matching , or Changing.
Map action can also Mark bonds that have changed in the reaction.
Keep existing mapping (on by default)
Note : Reactions are mapped by the AutoMapper User's Guidetool.
Example :
Action | Input | Output |
---|---|---|
Map (map ) |
Map input | Map output |
Map (map ) |
map input (reaction) | map output (reaction) |