Standardizer keep largest on heavy atom count

User 7c177bab3b

05-09-2011 10:23:06

Hi


The keepLargest action uses total atom count.


Is there a way to keepLargest on heavy atom count e.g. by specifying an evaluator function in the xml?


Thanks


Stephen

ChemAxon e08c317633

05-09-2011 11:13:06

Hi,


There's no way to do that at the moment. We will add an option to remove fragment / keep largest action to consider only heavy atoms.


Zsolt