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Data set of protein-ligand complexes with reliable experimental structures and affinities

active 2024-06-222025-12-28 (UTC)

Partial coverage16,680 / 21,121 hourly files (79%) · 2 absent upstream · 4,440 failed, retryable2024-03-152026-08-12 (UTC)— sampled evenly across the window, so rankings and trends hold; absolute counts scale up.
Events
27
Pushes
1
Pull requests
0
Issues
6
Stars
14
Forks
1

Activity over time

Daily event counts in the loaded window

Line chart, 555 days from 2024-06-22 to 2025-12-28. Pushes: 1 total, peak 1 in a day. Pull requests: 0 total, peak 0 in a day. Issues: 6 total, peak 1 in a day. Comments: 5 total, peak 2 in a day. Stars: 14 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

ContributorContributionsPushesPRsComments
zubatyuk3001
Honza-R3102
baogenduan3001
jrihon1000
georgebyron951001
selimsami1000

Recent activity

Latest issues, pull requests and releases

  • Issue comment#5georgebyron952025-10-02 13:31
    cuby4 sample input files
  • Issue comment#5Honza-R2025-10-02 12:24
    cuby4 sample input files
  • Issue#5selimsami2025-05-11 14:02
    cuby4 sample input files
  • Issue#3baogenduan2024-11-20 01:28
    the reproduced scores are not the same as those in the dataset
  • Issue comment#3baogenduan2024-11-20 01:27
    the reproduced scores are not the same as those in the dataset
  • Issue#3baogenduan2024-11-16 03:35
    the reproduced scores are not the same as those in the dataset
  • Issue#2jrihon2024-09-13 21:40
    Parameters for non-standard residues
  • Issue comment#1zubatyuk2024-08-10 14:28
    Total charge of protein used in DFT calculaions.
  • Issue#1zubatyuk2024-08-10 14:28
    Total charge of protein used in DFT calculaions.
  • Issue comment#1Honza-R2024-08-10 10:19
    Total charge of protein used in DFT calculaions.
  • Issue#1zubatyuk2024-08-09 18:59
    Total charge of protein used in DFT calculaions.

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.