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

Fixes NumberOfContacts CV (breaks API) #50

Merged
merged 4 commits into from
Jan 21, 2024

Conversation

craabreu
Copy link
Collaborator

Description

The NumberOfContacs construction now reads the total number of atoms, the exclusions, and whether to use periodic boundary conditions from a provided NonbondedForce object.

@craabreu craabreu merged commit c6642d4 into main Jan 21, 2024
10 checks passed
@craabreu craabreu deleted the pass-nonbonded-force-to-number-of-contacts branch January 31, 2024 15:41
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