XML configuration file for molecule descriptor

Greetings,

Would like to know how to create the molecule descriptor xml file, when adding a new descriptor using Jchem Manager https://www.chemaxon.com/jchem/doc/admin/

Thanks.

Hi,

You can find information about molecular descriptor generation here: http://www.chemaxon.com/jchem/doc/user/GenerateMD.html#cd and some xml configuration file examples in <home directory of installed JChem>/examples/config/.

Best regards,

Krisztina