Skip to content
New issue

Have a question about this project? Sign up for a free GitHub account to open an issue and contact its maintainers and the community.

By clicking “Sign up for GitHub”, you agree to our terms of service and privacy statement. We’ll occasionally send you account related emails.

Already on GitHub? Sign in to your account

Acpype - 120 MB #506

Closed
lkagami opened this issue Jul 20, 2020 · 3 comments
Closed

Acpype - 120 MB #506

lkagami opened this issue Jul 20, 2020 · 3 comments
Labels
limit request status: awaiting response Needs more information before proceeding

Comments

@lkagami
Copy link

lkagami commented Jul 20, 2020

Project

https://pypi.org/project/acpype/
Size of release/project

60MB
Which indexes

PyPI
Reasons for the request

A tool based in Python to use Antechamber to generate topologies for chemical compounds and to interface with others python applications. The Ambertools package absence for pype implies the addition of Antechamber binaries for the script execution. Please increase the upload capacity of the Acpype package to 120MB. Thanks a lot!
Luciano Porto Kagami

@jamadden
Copy link
Contributor

jamadden commented Jul 28, 2020

Do I understand that Antechamber is a third-party binary (native) program of around 120MB that you wish to distribute via PyPI?

If so, do you plan to compile and distribute wheels for each of your supported platforms? Right now there's a single wheel acpype-0.1.1-py2.py3-none-any.whl that specifies it runs on both Python 2 and Python 3 on any platform.

Distributing wheels containing binaries for Linux platforms may be somewhat complicated; the manylinux PEPs and docker images help with that.

In the future, PyPI may reject uploads containing Linux binaries if they are not manylinux compliant.

@pradyunsg pradyunsg added the status: awaiting response Needs more information before proceeding label Aug 5, 2020
@lkagami
Copy link
Author

lkagami commented Aug 10, 2020

Thanks for your response! The Ambertools package cannot be installed via yum, apt or similar command. It is necessary to add pre-builded binaries and assign environment variables. I am trying to use the suggested methods. I will contact you if I am unsuccessful. Thank you!

@di
Copy link
Member

di commented Nov 25, 2020

Closed due to lack of response. (Let us know if you were unsuccessful and this needs to be reopened).

@di di closed this as completed Nov 25, 2020
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
limit request status: awaiting response Needs more information before proceeding
Projects
None yet
Development

No branches or pull requests

4 participants