Hi,
I have just started to explore the many capabilities of CDK. An important
issue for me is the handling of stereochemistry while converting between
different file formats.
When I have created a CDK Molecule by parsing a Smile with stereochemistry,
is it possible to generate 2d coordinates with wedged bonds from this?
Thanks,
Dorothee
------------------------------------------------------------------------------
Live Security Virtual Conference
Exclusive live event will cover all the ways today's security and
threat landscape has changed and how IT managers can respond. Discussions
will include endpoint security, mobile security and the latest in malware
threats. http://www.accelacomm.com/jaw/sfrnl04242012/114/50122263/
_______________________________________________
Cdk-user mailing list
[email protected]
https://lists.sourceforge.net/lists/listinfo/cdk-user
