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.

Sign up for GitHub

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

Jump to bottom

Add docker image for building the OpenMM Plugin for DMFF #153

Merged
merged 3 commits into from
Jan 12, 2024
Merged

Add docker image for building the OpenMM Plugin for DMFF #153

merged 3 commits into from
Jan 12, 2024

Conversation

caic99
Copy link
Member

@caic99 caic99 commented Dec 12, 2023 •
edited
Loading

  1. Test the plugin in Python interface, reference platform.
python -m OpenMMDMFFPlugin.tests.test_dmff_plugin_nve -n 100
python -m OpenMMDMFFPlugin.tests.test_dmff_plugin_nvt -n 100 --platform CUDA

These commands does not work.

And there are deprecation notices from setuptools:

setup.py install is deprecated.
easy_install command is deprecated.

@KuangYu KuangYu merged commit dcc9fa5 into deepmodeling:master Jan 12, 2024
2 checks passed
Sign up for free to join this conversation on GitHub. Already have an account? Sign in to comment
Reviewers
No reviews
Assignees
No one assigned
Labels
None yet
Projects
None yet
Milestone
No milestone
Development

Successfully merging this pull request may close these issues.
3 participants
@caic99 @KuangYu @dingzhaohan