Skip to content

Pull requests: plumed/plumed2

New pull request New
Clear current search query, filters, and sorts
15 Open 555 Closed
15 Open 555 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

Added RMSD optimalAlignment GPU implementation wip Do not merge
#859 opened Sep 6, 2022 by zhang954527 Loading…
5 of 7 tasks
14
Cmake wip Do not merge
#934 opened May 10, 2023 by Iximiel • Draft
1 of 8 tasks
14
Reduced precision in output for a number of regtests as they were fai… wip Do not merge
#950 opened Jun 14, 2023 by gtribello Loading…
4 of 7 tasks
17
Optimize wholemolecules wip Do not merge
#1045 opened Mar 13, 2024 by GiovanniBussi Loading…
12
Typed vector and tensor
#1092 opened Jul 1, 2024 by Iximiel • Draft
3 of 7 tasks
12
Start on work on moving calculation of derivatives to apply loop for actions that pass vectors and matrices wip Do not merge
#1093 opened Jul 4, 2024 by gtribello • Draft
3 of 7 tasks
61
Proposing: compacting lower and upper walls into a single file
#1112 opened Sep 17, 2024 by Iximiel • Draft
1 of 7 tasks
Use process group signal handling to reach past the shell
#1126 opened Oct 9, 2024 by twhitehead Loading…
2 of 7 tasks
5
Macro for fasterMulticolvar+named modes
#1158 opened Nov 19, 2024 by Iximiel • Draft
3
Parallelization for AdjMatrices
#1159 opened Nov 26, 2024 by Iximiel • Draft
2
V2.10 patches/gromacs2025
#1162 opened Dec 2, 2024 by Iximiel • Draft
7 tasks
2
Added functionality to add DOIs to syntax file and then cite them using plumed.cite command
#1202 opened Feb 18, 2025 by gtribello Loading…
4 of 7 tasks
2
WIP for openacc (GPU) for MulticolvarTemplate
#1206 opened Feb 20, 2025 by Iximiel Loading…
10
New manual version wip Do not merge
#1207 opened Feb 21, 2025 by gtribello Loading…
3 of 7 tasks
13
Derivatives from back propagation and start of work on multicolvar GPUs
#1213 opened Feb 25, 2025 by gtribello Loading…
4 of 7 tasks
21
ProTip! Updated in the last three days: updated:>2025-02-25.