Brian Cole
Brian Cole
If I recall correctly from a presentation Brian Kelley did previously this is an intentional feature of RDKit as it allows R-group decomposition that maintains the stereochemistry of the attachment...
I'm running into this issue as well even when trying to get poetry to update itself: ``` $ poetry update self Updating dependencies Resolving dependencies... (1.4s) IsADirectoryError [Errno 21] Is...
Very cool! Which GUI sketchers let chemists generate these V3000 or CXSMILES variants?