Skip to content

BioSimSpace 2023.2.2
Compare
Choose a tag to compare
@lohedges lohedges released this 18 May 10:21
· 1090 commits to devel since this release
2023.2.2
This tag was signed with the committer’s verified signature. The key has expired.
lohedges Lester Hedges
GPG key ID: 50B4726A8EB2341D
Expired
Learn about vigilant mode.
f2ec932
This commit was signed with the committer’s verified signature. The key has expired.
lohedges Lester Hedges
GPG key ID: 50B4726A8EB2341D
Expired
Learn about vigilant mode.

This is the 2023.2.2 release of BioSimSpace.

What's Changed

  • Rename tests directory to tests for compliance with pytest standard by @lohedges in #51
  • Fix parsing of AMBER standard output records by @lohedges in #56
  • Re-add pre-minimisation stage to SOMD FEP configuration by @lohedges in #59
  • Fixed reference to plumed.dat file in AMBER configuration input for steered molecular dynamics by @lohedges in #64
  • Fixed BioSimSpace.Process.Amber.getDensity() method by @lohedges in #64

Full Changelog: 2023.2.1...2023.2.2

Contributors

lohedges
Assets 2
Loading