Python code to run Thermal Titration Molecular Dynamics (TTMD) simulations
active 2023-09-28 → 2026-02-25 (UTC)
Activity over time
Daily event counts in the loaded window
Line chart, 882 days from 2023-09-28 to 2026-02-25. Pushes: 45 total, peak 8 in a day. Pull requests: 4 total, peak 4 in a day. Issues: 5 total, peak 1 in a day. Comments: 27 total, peak 4 in a day. Stars: 14 total, peak 3 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 |
|---|---|---|---|---|
| molecularmodelingsection | 31 | 20 | 0 | 10 |
| rev7795 | 13 | 13 | 0 | 0 |
| saranthee | 11 | 0 | 0 | 10 |
| silviamenin | 9 | 8 | 1 | 0 |
| Andreaunipd98 | 7 | 4 | 3 | 0 |
| mglgc | 5 | 0 | 0 | 3 |
| surendramph | 3 | 0 | 0 | 2 |
| silviett | 1 | 0 | 0 | 1 |
| kulibour | 1 | 0 | 0 | 1 |
Recent activity
Latest issues, pull requests and releases
- Pull request#15Andreaunipd982024-08-23 09:57
- Pull request#15Andreaunipd982024-08-23 09:57
- Pull request#14silviamenin2024-08-23 09:53
- Pull request#14Andreaunipd982024-08-23 09:52
- Issue#13mglgc2024-08-06 18:34Where can we get the ttmd.txt file?
- Issue comment#12kulibour2024-07-30 06:50The topology and DCD trajectory files don't have the same number of atoms
- Issue comment#12saranthee2024-05-31 11:15The topology and DCD trajectory files don't have the same number of atoms
- Issue comment#12saranthee2024-04-09 13:40The topology and DCD trajectory files don't have the same number of atoms
- Issue comment#12silviett2024-04-09 13:01The topology and DCD trajectory files don't have the same number of atoms
- Issue#12saranthee2024-04-04 08:35The topology and DCD trajectory files don't have the same number of atoms
- Issue comment#11molecularmodelingsection2023-11-20 14:13TTMD Test Case Execution Error During 'equil1' Stage
- Issue#10molecularmodelingsection2023-11-20 12:44ACEMD expired license error running TTMD
- Issue comment#11surendramph2023-11-20 00:16TTMD Test Case Execution Error During 'equil1' Stage
- Issue comment#10mglgc2023-11-10 09:38ACEMD expired license error running TTMD
- Issue comment#10molecularmodelingsection2023-11-09 13:00ACEMD expired license error running TTMD
- Issue comment#10mglgc2023-11-09 08:41ACEMD expired license error running TTMD
- Issue comment#11molecularmodelingsection2023-11-09 08:14TTMD Test Case Execution Error During 'equil1' Stage
- Issue comment#10molecularmodelingsection2023-11-08 14:33ACEMD expired license error running TTMD
- Issue comment#11surendramph2023-11-07 03:01TTMD Test Case Execution Error During 'equil1' Stage
- Issue#11surendramph2023-11-05 22:43TTMD Test Case Execution Error During 'equil1' Stage
- Issue comment#10mglgc2023-10-25 08:50ACEMD expired license error running TTMD
- Issue comment#10molecularmodelingsection2023-10-24 13:12ACEMD expired license error running TTMD
- Issue#10mglgc2023-10-24 12:19ACEMD expired license error running TTMD
Totals cover only the window loaded into ClickHouse and count events, not GitHub's lifetime totals — 14 stars here means stars gained during the window, not the repo's star count.