It looks like the new version of OB is "fixing" stereochemistry behind the scenes even when it's not a desired behavior. Is there any way to make OB respect stereo information as given and not modify hash- or wedge-bond attributes?
See attached SD files, the structures 1,5, and 6 in particular. Igor
FullPage-2.3.0.sdf
Description: chemical/mdl-sdfile
FullPage-2.2.3.sdf
Description: chemical/mdl-sdfile
------------------------------------------------------------------------------ Increase Visibility of Your 3D Game App & Earn a Chance To Win $500! Tap into the largest installed PC base & get more eyes on your game by optimizing for Intel(R) Graphics Technology. Get started today with the Intel(R) Software Partner Program. Five $500 cash prizes are up for grabs. http://p.sf.net/sfu/intelisp-dev2dev
_______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel