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

Uploaded models discussed in paper #273

Open
wants to merge 1 commit into
base: master
Choose a base branch
from

Conversation

gorangiud
Copy link
Contributor

Description

Provide a brief description of the data being added here.

The yml files refer to models of 3CLpro in complex with different inhibitors. These are all described in this article: https://doi.org/10.1021/jacs.3c02229 and in the related SI

Status

  • YAML file for each piece of data
  • Ready to go

The yml files refer to models of 3CLpro in complex with different inhibitors. These are all described in this article: https://doi.org/10.1021/jacs.3c02229 and in the related SI
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Labels
None yet
Projects
None yet
Development

Successfully merging this pull request may close these issues.

1 participant