Skip to content

Pull requests: usnistgov/alignn

New pull request New
8 Open 108 Closed
8 Open 108 Closed
Author
Filter by author
Loading
Label
Filter by label
Loading
Use alt + click/return to exclude labels
or ⇧ + click/return for logical OR
Projects
Filter by project
Loading
Milestones
Filter by milestone
Loading
Reviews
Filter by reviews
No reviews Review required Approved review Changes requested
Assignee
Filter by who’s assigned
Assigned to nobody Loading
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Pull requests list

Remove singleton dimension in training routine
#189 opened Jun 5, 2025 by Andrew-S-Rosen Loading…
1
Lighten edges for line graph and better muti GPU options added
#186 opened Apr 16, 2025 by knc6 Loading…
1
update train_on_folder package
#156 opened Jun 21, 2024 by Alice0416 Loading…
1
modify ff.py file and add pre-trained folder.
#123 opened Jul 7, 2023 by dogs1231992 Loading…
3
compute bond angle cosines inside ALIGNNAtomWise.forward to ensure al…
#114 opened Jun 13, 2023 by bdecost Loading…
1
Bump pydantic from 1.8.1 to 1.8.2 dependencies Pull requests that update a dependency file
#96 opened Apr 8, 2023 by dependabot bot Loading…
1
add predict.py script
#92 opened Mar 6, 2023 by msehabibur Loading…
1
Print train/val/test sets with labels
#91 opened Jan 23, 2023 by pmiam Loading…
5
ProTip! Mix and match filters to narrow down what you’re looking for.