Releases: OpenBioSim/biosimspace
Releases · OpenBioSim/biosimspace
BioSimSpace 2024.3.0
BioSimSpace 2024.2.0
This is the 2024.2.0 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2024.1.0
This is the 2024.1.0 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.5.1
This is the 2023.5.1 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.5.0
This is the 2023.5.0 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.4.1
This is the 2023.4.1 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.4.0
This is the 2023.4.0 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.3.1
This is the 2023.3.0 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.3.0
This is the 2023.3.0 release of BioSimSpace. See the CHANGELOG for details.
BioSimSpace 2023.2.2
This is the 2023.2.2 release of BioSimSpace.
What's Changed
- Rename tests directory to
tests
for compliance withpytest
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