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alchemiscale-compute

a high-throughput alchemical free energy execution system for use with HPC, cloud, bare metal, and Folding@Home

Install from the command line
Learn more about packages
$ docker pull ghcr.io/openfreeenergy/alchemiscale-compute:latest

Recent tagged image versions

  • latest sha-7f57c64 v0.5.1 0.5.1 0.5
    Published 9 days ago · Digest
    sha256:e4d65708e0f2e337b219033db670cb5066855cc5e2eba7f8b2577ef20897ad3c
    395 Version downloads
  • sha-19c1f22 main
    Published 18 days ago · Digest
    sha256:fb703ac50a39bcf95b435e116d7e32f01d660f22954c1e2d9d3bc7523371db56
    4 Version downloads
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Last published

9 days ago

Discussions

9

Issues

85

Total downloads

399