diff --git a/docker/Dockerfile b/docker/Dockerfile index 93a870c..5ef6392 100644 --- a/docker/Dockerfile +++ b/docker/Dockerfile @@ -13,8 +13,7 @@ RUN conda install -y -c conda-forge \ conda-forge::matplotlib=3.11.1 \ conda-forge::nglview=4.0.1 RUN pip install --no-cache-dir \ - mdtraj==1.11.1.post2 \ - mdplus==0.1.2 + mdtraj==1.11.1.post2 COPY docker/fix-nglview.sh /tmp/fix-nglview.sh RUN bash /tmp/fix-nglview.sh