Mike Henry
Mike Henry
@mattwthompson I will get that dependency fixed on conda-forge soon :tm:
@mattwthompson false alarm, `openmmforcefields` doesn't pull in `espaloma`, but we want to install `espaloma` since it provides support for ML ff and works with `openmmforcefields`. So we need to install...
> I've always thought installing a local build overwrites whatever's in the environment, so I'm confused how this is an issue in the first place. It does, but my hunch...
Oh I think CI is going to fail since this is done on a fork and github wants to protect the secrets?
I'll try moving this to a branch
I think this will be a really great feature, I've added it to the milestone for v1.5
@rskye144 :wave: thanks for the bug report :heart_eyes: Are you interested in contributing a PR to fix this issue? We can provide some help/guidance if you are interested!
@atravitz you have been doing some excellent doc work lately, is this still an issue? I can't remember if made a decision on this.
We should also have this resolved by 2.x (if not sooner)
I'm in favor of seeing a "prototype" that is just ascii on how it will all look. Also +1 to using `_` for 3rd party code we vendor.