GROMACS 2024.3 release notes#
This version was released on TODO, 2024. These release notes document the changes that have taken place in GROMACS since the previous 2024.2 version, to fix known issues. It also incorporates all fixes made in version 2023.5 and earlier, which you can find described in the Release notes.
Fixes where mdrun could behave incorrectly#
Fixes for gmx tools#
Permit gmx tune_pme to understand md.log files#
The format of md.log files changed in 2024 which broke the ability of
gmx tune_pme to understand how previous runs worked by parsing that
file. Now gmx tune_pme understands better.
Avoid crash of convert-tpr on velocity-less tpr files#
The convert-tpr now works on tpr files that do not contain velocities, as generated for, e.g., energy minimization.