diff --git a/deepmd-kit/construct.yaml b/deepmd-kit/construct.yaml index 706bc75..a9524c2 100644 --- a/deepmd-kit/construct.yaml +++ b/deepmd-kit/construct.yaml @@ -24,6 +24,7 @@ specs: - nocuda {% endif %} - dpdata +- conda ignore_duplicate_files: True diff --git a/deepmd-kit/post_install.sh b/deepmd-kit/post_install.sh index 3c8e478..40ce8d4 100644 --- a/deepmd-kit/post_install.sh +++ b/deepmd-kit/post_install.sh @@ -1,4 +1,8 @@ cat << EOF +Please activate the environment before using the packages: + +/path/to/deepmd-kit/bin/conda activate /path/to/deepmd-kit + The following executable files have been installed: 1. DeePMD-kit CLi: dp -h 2. LAMMPS: lmp -h