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Python package to run molecular dynamics simulation of a protein-ligand complex with just a few lines

active 2025-06-052025-07-17 (UTC)

Partial coverage11,476 / 12,474 hourly files (92%) · 2 absent upstream · 994 failed, retryable2025-03-092026-08-10 (UTC)— sampled evenly across the window, so rankings and trends hold; absolute counts scale up.
Events
150
Pushes
22
Pull requests
15
Issues
1
Stars
88
Forks
17

Activity over time

Daily event counts in the loaded window

Line chart, 43 days from 2025-06-05 to 2025-07-17. Pushes: 22 total, peak 7 in a day. Pull requests: 15 total, peak 6 in a day. Issues: 1 total, peak 1 in a day. Comments: 6 total, peak 4 in a day. Stars: 88 total, peak 27 in a day.

  • Pushes
  • Pull requests
  • Issues
  • Comments
  • Stars

Top contributors

Pushes, PRs, issues, reviews and comments — stars and forks excluded, so this is contribution rather than popularity

ContributorContributionsPushesPRsComments
ingcoder2716101
OmarArias-Gaguancela10640
review-notebook-app[bot]4004
MuthusaravananS2001
TuresCode1010

Recent activity

Latest issues, pull requests and releases

  • Pull request#14ingcoder2025-07-17 01:05
  • Pull request#14OmarArias-Gaguancela2025-07-16 21:22
  • Pull request#13OmarArias-Gaguancela2025-07-16 20:59
  • Pull request#13ingcoder2025-07-16 20:34
  • Pull request#12ingcoder2025-07-16 19:02
  • Pull request#12OmarArias-Gaguancela2025-07-16 18:56
  • Pull request#11ingcoder2025-07-16 01:31
  • Issue comment#11review-notebook-app[bot]2025-07-15 22:38
    Changed directory of HTML visualization dashboard to /output/analysis
  • Pull request#11OmarArias-Gaguancela2025-07-15 22:38
  • Pull request#10ingcoder2025-07-15 21:53
  • Pull request#10ingcoder2025-07-15 21:52
  • Issue comment#9review-notebook-app[bot]2025-07-15 16:05
    Dev
  • Pull request#9ingcoder2025-07-15 16:05
  • Pull request#8ingcoder2025-07-15 16:03
  • Issue comment#8review-notebook-app[bot]2025-07-15 16:03
    Enhance MM/PBSA workflow by adding MMPBSA calculation functionality a…
  • Pull request#8ingcoder2025-07-15 16:03
  • Issue comment#7review-notebook-app[bot]2025-07-15 16:00
    Features i
  • Pull request#6ingcoder2025-07-13 23:36
  • Pull request#4TuresCode2025-06-18 07:04
  • Issue comment#1MuthusaravananS2025-06-12 15:10
    Amber prmtop file?
  • Issue#2MuthusaravananS2025-06-12 15:09
    force field avialable lsit.
  • Issue comment#1ingcoder2025-06-10 15:08
    Amber prmtop file?

Totals cover only the window loaded into ClickHouse and count events, not GitHub's lifetime totals — 88 stars here means stars gained during the window, not the repo's star count.