diff --git a/doc/source/changelog.rst b/doc/source/changelog.rst index 121f9815d..cca6b650e 100644 --- a/doc/source/changelog.rst +++ b/doc/source/changelog.rst @@ -58,6 +58,7 @@ organisation on `GitHub `__. of pinned dependencies for :mod:`sire`. This included fixing the way we specify ``blas`` so that we don't force a pin to ``openblas``, removing the requirement for ``watchdog`` as it is not used any more, + removing ``pypdb`` from the BioSimSpace run requirements, and switching to ``qt-main`` rather than the entire ``qt`` package. Our run dependencies are now just ``boost``, ``gsl``, ``lazy_import``, ``libnetcdf``, ``openmm``, ``pandas``, ``qt-main``, ``rich`` and ``tbb``. diff --git a/requirements_bss.txt b/requirements_bss.txt index 23faa5efd..f04cf3943 100644 --- a/requirements_bss.txt +++ b/requirements_bss.txt @@ -26,7 +26,6 @@ parmed py3dmol pydot pygtail -pypdb pyyaml rdkit