[gmx-developers] Upcoming second beta for GROMACS 2020

Eric Irrgang ericirrgang at gmail.com
Fri Oct 11 18:41:01 CEST 2019


The primary install case for the Python package is via `pip`.
The Python package docs for the beta 2 release can be previewed at
https://kassonlab.github.io/gmxapi/  or built from `master`. Set
GMX_PYTHON_PACKAGE=ON for full module documentation.
Please let me know if you have additional questions.
Also note https://redmine.gromacs.org/issues/2896

On Thu, Oct 10, 2019 at 5:24 PM Alexey Shvetsov <alexxy at omrb.pnpi.spb.ru>
wrote:

> I tested 2020-beta1 and found that seems like install target missing for
> python bindigns. Is it supposed to be installed via Cmake or via pip?
>
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