# Python package sources
This directory exists as a staging area supporting GROMACS enhancement
-[#2045](https://redmine.gromacs.org/issues/2045),
+[#2045](https://gitlab.com/gromacs/gromacs/-/issues/2045),
which attempts to update the gmxapi efforts from GROMACS 2019,
merge external repositories from
https://github.com/kassonlab/gmxapi
pytest test
For additional discussion on packaging and distribution, see
-https://redmine.gromacs.org/issues/2896
+https://gitlab.com/gromacs/gromacs/-/issues/2896
## Sample MD extension code
Hint: the fork point from `master` and the current git ref can be set as environment variables:
- FORKPOINT=$(git show -s --pretty=format:"%h" `git merge-base gerrit_master HEAD`)
+ FORKPOINT=$(git show -s --pretty=format:"%h" `git merge-base master HEAD`)
REF=`git show -s --pretty=format:"%h"`
## External project code
`pip install -r requirements.txt`, as above.
Note: scikit-build is only required for convenient management of the Python
-build environment and packaging. See https://redmine.gromacs.org/issues/2896
+build environment and packaging. See https://gitlab.com/gromacs/gromacs/-/issues/2896
# pybind11