Bemis-Murcko frameworks retaining atom type and hybrization?

User a83787b4e1

22-04-2010 19:23:13

Hi,


I am using the frameworks calculator plug-ins to obtain the Bemis-Murcko frameworks, but I am wondering if I can get the frameworks with atom type, bond hybridization and bond order?


 


 

ChemAxon 8b644e6bf4

23-04-2010 14:25:26

Hi,


We will implement optionally weaker atom/bond type
generalization in the frameworks plugin in version 5.4 (expected in Q3
2010).



This will include "clipping side chain" functionality. 


We will notify you in this topic when the new features are available.


Regards,


Gabor