Skip to content

Release 0.9.4

Compare
Choose a tag to compare
@ijpulidos ijpulidos released this 25 Feb 20:31
· 113 commits to main since this release
691d890

What's Changed

Full Changelog: 0.9.3...0.9.4

Benchmark data

Benchmarks run with small molecule force field (ff) and protein ff, openff-2.0.0 and ff14SB, respectively.

  • tyk2

    • 5ns/replica:
      plot_absolute_5ns
      plot_relative_5ns
    • 1ns/replica:
      plot_absolute_1ns
      plot_relative_1ns
  • jnk1:

    • 5ns/replica:
      plot_absolute_5ns
      plot_relative_5ns
    • 1ns/replica:
      plot_absolute_1ns
      plot_relative_1ns