Combinatorial reaction on Jchem for Excel?

User d61d1784e3

29-10-2010 21:59:21

Hi. I want to do a combinatorial reaction on Excel.


I know there is a function called JCReactReactionStructure which works by selecting one molecule.


Is there a way to select multiple structures to do reaction?

ChemAxon bd13b5bd77

02-11-2010 17:02:33

Hi Jong,


 


please check:


https://www.chemaxon.com/conf/JChem_for_Excel_User_Guide_for_Office_2007.pdf


section: 



9.2.2.4 Reactor


e.g.; =JCReactReactionStructure(A1;A2;B1)
where A1 cell contains the generic reaction (template), A2 and B1 contain the specific reactants.
the result goes to the B2 cell.


 




Viktor




 



 

ChemAxon 0e37943a96

02-11-2010 17:04:26

Hi,


the function has multiple optional input parameters. You can select up to 4 reactants (note that Reactant3 and 4 are towards the end of the parameter list).


JCReactReactionStructure will give the resulting reaction, whereas JCReactProductStructure only the product.


Best regards,


Tamas.