about strcuture search in reactor table

User 22c88daf92

06-12-2012 04:11:20

hello!


we try to use the structure search of JchemBase in reactor table, we find that:


1.   the single structure can be used to search out the reactor which include this molecule as reagents or productions.


2.   the whole reactor string (such as .rxn format ) can be used to search out the exactly  same reactor.


Now, we want to know, how to using other type of structure search (such as Similarity search, and so on) to the reactor table? Is there any examples in java?


thanks!


 

ChemAxon abe887c64e

06-12-2012 10:47:31

Please find Java code examples on this page:


https://www.chemaxon.com/jchem/examples/java/html/index.html


Best regards,


Krisztina

ChemAxon a3d59b832c

06-12-2012 12:48:25

Hi,


 


With reaction tables, you can use all search types. For similarity, you will have different types: reactant, product and different kinds of reaction similarity types. For more details on reaction similarity search, see:


 


http://www.chemaxon.com/jchem/doc/user/RFp.html


 


Best regards,


Szabolcs