Community-Maintained Version of mordred

[JacksonBurns]

mordred is important to many cheminformatics tasks but is no longer being maintained. I have made a fork of mordred called mordred-community and am happy to review and merge PRs!

So far I have taken all of the outstanding changes on this repo and relased mordredcommunity on PyPI: pip install mordredcommunity

[TUstudents]

"That's a fantastic idea! I'm glad you're taking the lead on this.

[TUstudents]

Will you add the issues tracker and discussions page on your fork?

[JacksonBurns]

Just did, thanks for the suggestion @TUstudents

[TUstudents]

Thanks for fixing the issue with recent numpy versions, so I do not even need to write a bug report :)

As you created the pypi package, basically the road is open to have a conda version (custom channel) too?

[JacksonBurns]

Yes, I will get it on conda shortly. I'd like to get it on conda-forge as well.

[JacksonBurns]

If anyone sees this in the future, mordredcommunity is now available via conda-forge.