Update release note on QM/MM deprication

The previous release note made it sound like the ongoing
CP2K interface development is providing code that is
"untested and likely dysfunctional"

This is not the case, it is the best functioning interface
at the moment and while not part of the official GROMACS code
base, has seen more through testing than any other QM/MM
interface.

diff --git a/docs/release-notes/2021/major/miscellaneous.rst b/docs/release-notes/2021/major/miscellaneous.rst
index 91f8cca080fa528083c76d2dd3f0b83960cc83b7..dfa74e3dba3c31f8aedbf15b356520871d58cba4 100644 (file)
--- a/docs/release-notes/2021/major/miscellaneous.rst
+++ b/docs/release-notes/2021/major/miscellaneous.rst
@@ -52,6 +52,7 @@ The environment variables that had exactly the same meaning in OpenCL and CUDA w
 Dysfunctional parts of the QMMM interface has been removed
 """"""""""""""""""""""""""""""""""""""""""""""""""""""""""
 
-Currently, GROMACS supports QM/MM officially only via MiMiC. All other QM/MM
+Currently, GROMACS supports QM/MM officially only via MiMiC; a new CP2K QM/MM interface is being
+developed within BioExcel. All other QM/MM
 support has been untested and likely dysfunctional for years and has now been removed from .mdp
 input and output, resulting in smaller .mdp output files from grompp.