Hi, Has anyone successfully generated IUPAC names from a smiles string? I see some code in the legacy module, but did not see a way to do it. Also, any suggestions for doing this with some other open source software?
Thanks, Yong CONFIDENTIALITY NOTICE: This electronic mail transmission may contain privileged, confidential and/or sensitive information and is intended only for the review of the party to whom it is addressed and for the stated purpose. Unauthorized use or disclosure is strictly prohibited. If you have received this transmission in error, please notify eupriv...@blueprintmedicines.com if you’re in the EU or priv...@blueprintmedicines.com for all other locations. Then immediately delete the transmission without reading its contents.
_______________________________________________ Cdk-user mailing list Cdk-user@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/cdk-user
