Migrate issues and close this repo?

MobleyLab / FreeSolv

Experimental and calculated small molecule hydration free energies

http://www.escholarship.org/uc/item/6sd403pz

101 stars 53 forks source link

Migrate issues and close this repo? #25

Closed davidlmobley closed 7 years ago

davidlmobley commented 8 years ago

@jchodera - do you have any objection to closing this repo, or at least updating the README.md to reflect that the official repo is elsewhere, if I migrate the issues over to github.com/mobleylab/freesolv?

Now that my group is up on GitHub, it would probably be best for me to continue to maintain this on our site rather than yours, especially since we have some updates coming soon.

jchodera commented 8 years ago

The official repo is elsewhere?

jchodera commented 8 years ago

Wait, when and how did this happen? What is the official repo?

jchodera commented 8 years ago

Ah, I see, you have a fork in mobleylab.

How about this:

You delete your fork
I transfer the repository to mobleylab so that you own the main repo
We enable zenodo integration so we automatically assign a DOI to each release, and add a zenodo badge to the README.md
We update the README.md with the list of contributors from my lab who helped with the cleanup here so we don't accidentally leave anyone off future publications, and so they get credit
We cut a new release

davidlmobley commented 8 years ago

@jchodera - sounds great. I'll delete my fork now. Thanks.

davidlmobley commented 8 years ago

Also, I definitely need to know who was involved with any sort of extensive cleanup (I didn't recall that anyone had done anything substantial other than put it onto GitHub, but that's why it's important to have a record) as we're going to have a new paper soon so we'll need them for the authors list.

davidlmobley commented 8 years ago

OK, my fork is now deleted, @jchodera . Thanks.

jchodera commented 8 years ago

Looks like I need temporary admin rights to mobleylab:

You don’t have admin rights to MobleyLab

davidlmobley commented 8 years ago

I just sent an invite to the requisite team, @jchodera .

jchodera commented 8 years ago

Transferred!

Can you handle the other steps?

[ ] Enable zenodo integration so we automatically assign a DOI to each release, and add a zenodo badge to the README.md
[ ] Update the README.md with the list of contributors from my lab who helped with the cleanup here so we don't accidentally leave anyone off future publications, and so they get credit. You can use the git commit history to check.
[ ] Cut a new minor release, which will trigger a zenodo DOI assignment

davidlmobley commented 8 years ago

Mostly, yes, @jchodera - except that I need to know if there is anyone from your lab who did anything NOT recorded in the pull requests. The pull requests basically just show three things:

Lee-Ping added a column to a text file by pulling it from a pickle file
Kyle removed some extra files left behind by Antechamber
You added a script to charge molecules via Bayly's recommended procedure

All of the other issues I'm seeing on there were initiated and resolved by me. But maybe I'm missing other important contributions from your group??

Unless I'm missing additional contributions, this probably means you would get included on a publication and the other two would likely get acknowledgments...?