Skip to content

Pull requests: Colvars/colvars

New pull request New
13 Open 336 Closed
13 Open 336 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
Sort
Sort by
Newest Oldest Most commented Least commented Recently updated Least recently updated Best match
Most reactions
👍 👎 😄 🎉 😕 ❤️ 🚀 👀

Pull requests list

Fix undefined behavior when getting the current working directory from std::filesystem bugfix To be used only in PRs
#728 opened Oct 12, 2024 by giacomofiorin Loading…
1
[RFC] fix: try to solve #87 for non-scala components bugfix To be used only in PRs
#713 opened Sep 12, 2024 by HanatoK Loading…
1
41
Ability to define custom grid in ABF biases
#710 opened Aug 30, 2024 by jhenin Loading…
3 tasks done
3
Implementation of OPES in Colvars
#709 opened Aug 27, 2024 by HanatoK Loading…
8 tasks done
32
[RFC] More band-aid fixes to Colvars
#700 opened Jun 29, 2024 by HanatoK • Draft
1 task done
21
Create abf::setup_output() for consistency
#687 opened Apr 12, 2024 by jhenin • Draft
1
Protein-specific coordinates based on index groups GROMACS
#666 opened Feb 27, 2024 by jhenin • Draft
2 of 4 tasks
2
Lambda-ABF implementation for the NAMD interface
#649 opened Jan 19, 2024 by jhenin • Draft
1 task done
7
Allow reusing computation and data between CVC objects optimization
#644 opened Dec 19, 2023 by giacomofiorin • Draft
1 of 3 tasks
15
Gmx no cv config test GROMACS testing Only affects CI; not listed in outside PRs
#627 opened Nov 24, 2023 by jhenin • Draft
enable use of CVs defined by PyTorch neural network models
#570 opened Aug 28, 2023 by zwpku Loading…
69
Enable CTest on Windows builds
#533 opened May 3, 2023 by giacomofiorin • Draft
Meta reflection
#525 opened Apr 17, 2023 by fabsugar • Draft
5
ProTip! no:milestone will show everything without a milestone.