search

openforcefield / open-forcefield-tools

Tools for open forcefield development
MIT License
8 stars 6 forks source link

Expunge large objects from git repo, or migrate to toolkit repo #27

Open jchodera opened 6 years ago

jchodera commented 6 years ago

This repo contains some very large (now deleted) objects, bringing the repo to ~2GB. We should either expunge those or migrate this code to the main toolkit repo: https://github.com/openforcefield/openforcefield

jchodera commented 6 years ago

Ah. The problem is with single-molecule-property-generation/, which somehow ballooned to 1.5GB:

lski2414:open-forcefield-tools choderaj$ du -sh single-molecule-property-generation/
1.5G    single-molecule-property-generation/

@bmanubay and @mrshirts : Was this you?

jchodera commented 6 years ago

We shouldn't be checking datafiles into this repo. And now that we have, it's going to take some work to undo that.

I'm thinking we should just move the property calculator to the main toolkit and abandon this repo instead.

bmanubay commented 6 years ago

Yes, this was me. Sorry. I agree that this repo can be abandoned.