build: bump LAMMPS version to stable_22Jul2025_update2 #5052
Conversation
This file contains hidden or bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Co-authored-by: njzjz <9496702+njzjz@users.noreply.github.com>
Copilot
AI
changed the title
[WIP] Bump LAMMPS version to stable_22Jul2025_update2
build: bump LAMMPS version to stable_22Jul2025_update2
Nov 14, 2025
Member
Co-authored-by: njzjz <9496702+njzjz@users.noreply.github.com>
njzjz
approved these changes
Nov 14, 2025
Contributor
There was a problem hiding this comment.
Pull Request Overview
This PR updates the LAMMPS version reference from stable_22Jul2025_update1 to stable_22Jul2025_update2 across the entire codebase.
- Systematically updates all LAMMPS version references in build scripts, test scripts, and development container configurations
- Updates installation documentation to reflect the new LAMMPS version tag
- Updates Python package dependency version to match the new LAMMPS release
Reviewed Changes
Copilot reviewed 8 out of 8 changed files in this pull request and generated no comments.
Show a summary per file
| File | Description |
|---|---|
.devcontainer/build_cxx.sh |
Updates LAMMPS_VERSION CMake argument in devcontainer build script |
source/install/build_cc.sh |
Updates LAMMPS_VERSION in C++ build script |
source/install/build_from_c.sh |
Updates LAMMPS_VERSION in C interface build script |
source/install/build_lammps.sh |
Updates LAMMPS_VERSION variable for LAMMPS download and build |
source/install/test_cc.sh |
Updates LAMMPS_VERSION in C++ test build script |
source/install/test_cc_local.sh |
Updates LAMMPS_VERSION CMake argument in local test script |
pyproject.toml |
Updates lammps[mpi] dependency version to 2025.7.22.2.0 and DP_LAMMPS_VERSION environment variables for CI builds |
doc/install/install-lammps.md |
Updates all documentation references to use the new stable_22Jul2025_update2 version tag |
💡 Add Copilot custom instructions for smarter, more guided reviews. Learn how to get started.
wanghan-iapcm
approved these changes
Nov 18, 2025
Codecov Report✅ All modified and coverable lines are covered by tests. Additional details and impacted files@@ Coverage Diff @@
## devel #5052 +/- ##
==========================================
+ Coverage 84.18% 84.24% +0.05%
==========================================
Files 709 709
Lines 70217 70171 -46
Branches 3620 3604 -16
==========================================
Hits 59114 59114
+ Misses 9936 9890 -46
Partials 1167 1167 ☔ View full report in Codecov by Sentry. 🚀 New features to boost your workflow:
|
ChiahsinChu
pushed a commit
to ChiahsinChu/deepmd-kit
that referenced
this pull request
Dec 17, 2025
…5052) Updates LAMMPS version reference from `stable_22Jul2025_update1` to `stable_22Jul2025_update2` across build scripts, documentation, and Python package configuration. ### Changes - Build configuration scripts: `.devcontainer/build_cxx.sh`, `source/install/{build_cc.sh, build_from_c.sh, build_lammps.sh, test_cc.sh, test_cc_local.sh}` - Installation documentation: `doc/install/install-lammps.md` - Python package configuration: `pyproject.toml` (updated `lammps[mpi]` dependency to `~=2025.7.22.2.0` and CI environment variables for macOS and Linux) All references to the LAMMPS version tag have been updated consistently across the repository, following the pattern from commit 0fe38c8. - Fixes deepmodeling#5051 <!-- START COPILOT CODING AGENT SUFFIX --> <details> <summary>Original prompt</summary> > > ---- > > *This section details on the original issue you should resolve* > > <issue_title>Bump LAMMPS version to stable_22Jul2025_update2</issue_title> > <issue_description>### Summary > > Bump LAMMPS version to stable_22Jul2025_update2. > > ### Detailed Description > > Follow the style of deepmodeling#4955 (0fe38c8). > > ### Further Information, Files, and Links > > _No response_</issue_description> > > ## Comments on the Issue (you are @copilot in this section) > > <comments> > </comments> > </details> - Fixes deepmodeling#5051 <!-- START COPILOT CODING AGENT TIPS --> --- 💡 You can make Copilot smarter by setting up custom instructions, customizing its development environment and configuring Model Context Protocol (MCP) servers. Learn more [Copilot coding agent tips](https://gh.io/copilot-coding-agent-tips) in the docs. --------- Co-authored-by: copilot-swe-agent[bot] <198982749+Copilot@users.noreply.github.com> Co-authored-by: njzjz <9496702+njzjz@users.noreply.github.com>
Sign up for free
to join this conversation on GitHub.
Already have an account?
Sign in to comment
Add this suggestion to a batch that can be applied as a single commit.
This suggestion is invalid because no changes were made to the code.
Suggestions cannot be applied while the pull request is closed.
Suggestions cannot be applied while viewing a subset of changes.
Only one suggestion per line can be applied in a batch.
Add this suggestion to a batch that can be applied as a single commit.
Applying suggestions on deleted lines is not supported.
You must change the existing code in this line in order to create a valid suggestion.
Outdated suggestions cannot be applied.
This suggestion has been applied or marked resolved.
Suggestions cannot be applied from pending reviews.
Suggestions cannot be applied on multi-line comments.
Suggestions cannot be applied while the pull request is queued to merge.
Suggestion cannot be applied right now. Please check back later.
Updates LAMMPS version reference from
stable_22Jul2025_update1tostable_22Jul2025_update2across build scripts, documentation, and Python package configuration.Changes
.devcontainer/build_cxx.sh,source/install/{build_cc.sh, build_from_c.sh, build_lammps.sh, test_cc.sh, test_cc_local.sh}doc/install/install-lammps.mdpyproject.toml(updatedlammps[mpi]dependency to~=2025.7.22.2.0and CI environment variables for macOS and Linux)All references to the LAMMPS version tag have been updated consistently across the repository, following the pattern from commit 0fe38c8.
Original prompt
💡 You can make Copilot smarter by setting up custom instructions, customizing its development environment and configuring Model Context Protocol (MCP) servers. Learn more Copilot coding agent tips in the docs.