django-rdkit
django-rdkit copied to clipboard
add new param for enhanced stereo sss
Looks like there is a new-ish parameter for enhanced stereo during substructure searching: do_enhanced_stereo_sss
. Currently, if I try setting that, I get an exception:
self = <django_rdkit.config.Config object at 0x7fffc8214460>
name = 'do_enhanced_stereo_sss', value = True
def __setattr__(self, name, value):
if not name in _PARAMETERS:
> raise AttributeError
E AttributeError
/usr/local/lib/python3.10/site-packages/django_rdkit/config.py:28: AttributeError
This adds support for setting that value via django_rdkit
. Monkey-patching locally with this works when doing searches in Postgres with the RDKit cartridge.