Skip to content

Update fragment_types.py to add SanitizeMol calls#61

Open
JWallaceEvotec wants to merge 1 commit intordkit:masterfrom
JWallaceEvotec:sanitize_fragments
Open

Update fragment_types.py to add SanitizeMol calls#61
JWallaceEvotec wants to merge 1 commit intordkit:masterfrom
JWallaceEvotec:sanitize_fragments

Conversation

@JWallaceEvotec
Copy link
Contributor

This fixes an issue seen where unitialized ring systems confuse the fragmentor, that leads to errors in processing.

This fixes an issue seen where unitialized ring systems confuse the fragmentor
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment

Labels

None yet

Projects

None yet

Development

Successfully merging this pull request may close these issues.

1 participant