Thank you for reading this email.I have a question to confirm:

I want to get the 3D coordinates of the molecules,after operations just like 
your example:

obabelligand.babel.smi-Oligand.babel.sdf--gen3d--conformer--nconf20--weighted

 Can we think of this conformation  as the most stable conformation of the 
molecule which is the global  minimum conformation of the molecule? Does it 
need to be optimized if I need use the conformation for futher computer ?

I shall be most grateful if I receive your letter !
_______________________________________________
OpenBabel-discuss mailing list
OpenBabel-discuss@lists.sourceforge.net
https://lists.sourceforge.net/lists/listinfo/openbabel-discuss

Reply via email to