automate the setup of atomistic clay models for classical molecular dynamics simulations with GROMACS
active 2025-05-27 → 2025-12-27 (UTC)
Activity over time
Daily event counts in the loaded window
Line chart, 215 days from 2025-05-27 to 2025-12-27. Pushes: 0 total, peak 0 in a day. Pull requests: 0 total, peak 0 in a day. Issues: 17 total, peak 15 in a day. Comments: 0 total, peak 0 in a day. Stars: 3 total, peak 1 in a day.
- Pushes
- Pull requests
- Issues
- Comments
- Stars
Stars, PRs, issues and forks are under-captured in the later part of this window. GH Archive progressively stopped capturing non-push events during 2026 — −95% or worse by the end of the window. Every series here except Pushes fades for that reason, so a decline above reflects the archive, not this repository. Pushes stay reliable throughout, so read them, and the contributor counts derived from them, as the real signal. Data health has the measurements.
Top contributors
Pushes, PRs, issues, reviews and comments — stars and forks excluded, so this is contribution rather than popularity
| Contributor | Contributions | Pushes | PRs | Comments |
|---|---|---|---|---|
| punkpony | 14 | 0 | 0 | 0 |
| ClayCodeuser | 1 | 0 | 0 | 0 |
| Michelle-Ernst0 | 1 | 0 | 0 | 0 |
| sarahvs99 | 1 | 0 | 0 | 0 |
Recent activity
Latest issues, pull requests and releases
- Issue#99ClayCodeuser2025-12-27 21:43Install issue
- Issue#97sarahvs992025-08-14 14:38Parsing of UCS names expects exactly 5 characters
- Issue#96Michelle-Ernst02025-05-27 16:14empty .top file
- Issue#95punkpony2025-05-27 15:41Interruption during preparation
- Issue#56punkpony2025-05-27 15:38progress bar writes to new line
- Issue#57punkpony2025-05-27 15:38handle UCs with substitutions affecting charges across PBC
- Issue#55punkpony2025-05-27 15:38keyword for naming the output folder
- Issue#54punkpony2025-05-27 15:38new built handling of old files
- Issue#50punkpony2025-05-27 15:38allow entry of charge value as '+4'
- Issue#51punkpony2025-05-27 15:38check new UC cells
- Issue#37punkpony2025-05-27 15:38`GROMACS raised error code 1!` <- unclear
- Issue#46punkpony2025-05-27 15:38claycode documentations + tutorials online
- Issue#49punkpony2025-05-27 15:38make builder/tests a developer test only
- Issue#33punkpony2025-05-27 15:38Force fields for release
- Issue#35punkpony2025-05-27 15:38output to the screen during run
- Issue#30punkpony2025-05-27 15:38branches keep tidy
- Issue#32punkpony2025-05-27 15:38Clean up the ClayCode - remove things that do not belong
Totals cover only the window loaded into ClickHouse and count events, not GitHub's lifetime totals — 3 stars here means stars gained during the window, not the repo's star count.