Experimental and calculated small molecule hydration free energies
active 2023-08-25 → 2026-05-01 (UTC)
Activity over time
Daily event counts in the loaded window
Line chart, 981 days from 2023-08-25 to 2026-05-01. Pushes: 0 total, peak 0 in a day. Pull requests: 0 total, peak 0 in a day. Issues: 3 total, peak 1 in a day. Comments: 8 total, peak 1 in a day. Stars: 41 total, peak 2 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 |
|---|---|---|---|---|
| davidlmobley | 4 | 0 | 0 | 4 |
| dingye18 | 2 | 0 | 0 | 1 |
| lmuellender | 2 | 0 | 0 | 2 |
| xiaowei-xie2 | 2 | 0 | 0 | 1 |
| IAlibay | 1 | 0 | 0 | 0 |
Recent activity
Latest issues, pull requests and releases
- Issue#56IAlibay2026-02-11 15:09Add a license file?
- Issue comment#53lmuellender2025-07-17 12:55Charge in consistency between the files in gromacs_solvated.tar.gz and gromacs.tar.gz
- Issue comment#53lmuellender2025-07-16 12:24Charge in consistency between the files in gromacs_solvated.tar.gz and gromacs.tar.gz
- Issue comment#55davidlmobley2025-07-01 16:04Erroneous nitrates in SDF files
- Issue comment#54davidlmobley2025-06-30 22:52Potential issues with the experimental hydration free energies for mobley_4850657 (methanesulfonyl chloride) and mobley_9201263 (methyl methanesulfonate)?
- Issue comment#54davidlmobley2025-06-16 20:36Potential issues with the experimental hydration free energies for mobley_4850657 (methanesulfonyl chloride) and mobley_9201263 (methyl methanesulfonate)?
- Issue comment#54xiaowei-xie22025-06-12 22:09Potential issues with the experimental hydration free energies for mobley_4850657 (methanesulfonyl chloride) and mobley_9201263 (methyl methanesulfonate)?
- Issue#54xiaowei-xie22025-06-12 21:16Potential issues with the experimental hydration free energies for mobley_4850657 (methanesulfonyl chloride) and mobley_9201263 (methyl methanesulfonate)?
- Issue comment#53dingye182024-11-22 04:30Charge in consistency between the files in gromacs_solvated.tar.gz and gromacs.tar.gz
- Issue comment#53davidlmobley2024-11-19 22:39Charge in consistency between the files in gromacs_solvated.tar.gz and gromacs.tar.gz
- Issue#53dingye182024-11-19 03:21Charge in consistency between the files in gromacs_solvated.tar.gz and gromacs.tar.gz
Totals cover only the window loaded into ClickHouse and count events, not GitHub's lifetime totals — 41 stars here means stars gained during the window, not the repo's star count.