The Surface Assessment via Grid Evaluation (SuAVE) software was developed to account for the effect of curvature in the calculations of structural properties of chemical interfaces regardless of chemical composition, asymmetry, and level of atom coarseness. It employs differential geometry techniques, enabling the representation of chemical surfaces as fully differentiable. The SuAVE software v2.0 is fully parallel and benefits from a compiler that supports OpenMP.
active 2023-08-15 → 2026-01-22 (UTC)
Activity over time
Daily event counts in the loaded window
Line chart, 892 days from 2023-08-15 to 2026-01-22. Pushes: 43 total, peak 18 in a day. Pull requests: 1 total, peak 1 in a day. Issues: 9 total, peak 3 in a day. Comments: 4 total, peak 1 in a day. Stars: 5 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 |
|---|---|---|---|---|
| SuAVE-Software | 51 | 43 | 1 | 3 |
| dineshchemistry | 4 | 0 | 0 | 1 |
| T98G | 1 | 0 | 0 | 0 |
| Beliavsky | 1 | 0 | 0 | 0 |
Recent activity
Latest issues, pull requests and releases
- Pull request#7SuAVE-Software2026-01-22 14:24
- Issue#6SuAVE-Software2025-06-05 20:21vesicle.pdb is missing
- Issue comment#6SuAVE-Software2025-06-05 20:21vesicle.pdb is missing
- Issue#6dineshchemistry2025-05-09 11:18vesicle.pdb is missing
- Issue comment#5dineshchemistry2025-05-09 06:04Issue with s_grid
- Issue#5dineshchemistry2025-05-09 06:04Issue with s_grid
- Issue#5dineshchemistry2025-05-07 07:02Issue with s_grid
- Issue#4SuAVE-Software2024-09-26 19:50instal_lib.sh yields error on Installation of SuAVE 2.24.07
- Issue comment#4SuAVE-Software2024-09-26 19:47instal_lib.sh yields error on Installation of SuAVE 2.24.07
- Issue#1SuAVE-Software2024-09-26 17:30Missing files for new users
- Issue#3SuAVE-Software2024-09-26 17:30Add topic tag `chemistry`
- Issue comment#3SuAVE-Software2024-09-20 11:56Add topic tag `chemistry`
- Issue#4T98G2024-08-25 17:00instal_lib.sh yields error on Installation of SuAVE 2.24.07
- Issue#3Beliavsky2024-08-18 11:27Add topic tag `chemistry`
- ReleaseSuAVE-Software2024-08-18 00:42suave_v2.24.07
- ReleaseSuAVE-Software2023-12-11 20:12suave_v2.23.12
- ReleaseSuAVE-Software2023-12-11 20:08source_v2.12.04
- ReleaseSuAVE-Software2023-12-11 20:01source_v2.12.04
Totals cover only the window loaded into ClickHouse and count events, not GitHub's lifetime totals — 5 stars here means stars gained during the window, not the repo's star count.