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

Fix openbabel forcefield integration #1589

Merged
merged 4 commits into from
Feb 2, 2024

Commits on Feb 2, 2024

  1. Add a "force" command, mostly for debugging

    Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
    ghutchis committed Feb 2, 2024
    Configuration menu
    Copy the full SHA
    3192954 View commit details
    Browse the repository at this point in the history
  2. Working obmm interface using wait for now

    Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
    ghutchis committed Feb 2, 2024
    Configuration menu
    Copy the full SHA
    eb7b180 View commit details
    Browse the repository at this point in the history
  3. Decrease latency

    Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
    ghutchis committed Feb 2, 2024
    Configuration menu
    Copy the full SHA
    5631f0d View commit details
    Browse the repository at this point in the history
  4. Some cleanups of unused code

    Signed-off-by: Geoff Hutchison <geoff.hutchison@gmail.com>
    ghutchis committed Feb 2, 2024
    Configuration menu
    Copy the full SHA
    d095e6b View commit details
    Browse the repository at this point in the history