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) |
Map input
Map output
map input (reaction)
map output (reaction)