From 72df11336441de5a63d23668d7347bed39e6007f Mon Sep 17 00:00:00 2001 From: "renovate[bot]" <29139614+renovate[bot]@users.noreply.github.com> Date: Fri, 9 Oct 2026 06:36:15 +0000 Subject: [PATCH] Update dependency mdtraj to v1.11.2 --- docker/Dockerfile | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/docker/Dockerfile b/docker/Dockerfile index e188632..8bf7dd4 100644 --- a/docker/Dockerfile +++ b/docker/Dockerfile @@ -17,7 +17,7 @@ RUN conda install -y -c conda-forge \ conda-forge::numpy=2.5.3 \ conda-forge::scikit-learn=1.9.1 \ conda-forge::tqdm=4.70.1 \ - conda-forge::mdtraj=1.11.1 \ + conda-forge::mdtraj=1.11.2 \ conda-forge::iprogress=0.4 \ conda-forge::ipywidgets=8.1.9 \ conda-forge::gromacs=2026.3=nompi_*