From f45310c62e1aef17941413e56f1b6ee52fff2eea Mon Sep 17 00:00:00 2001 From: Matthias Krack Date: Mon, 17 Feb 2025 10:17:58 +0100 Subject: [PATCH] Perform DBCSR toolchain build for 3rd party tests --- tools/docker/Dockerfile.test_aiida | 2 +- tools/docker/Dockerfile.test_ase | 2 +- tools/docker/Dockerfile.test_gromacs | 2 +- tools/docker/Dockerfile.test_i-pi | 2 +- tools/docker/generate_dockerfiles.py | 2 +- 5 files changed, 5 insertions(+), 5 deletions(-) diff --git a/tools/docker/Dockerfile.test_aiida b/tools/docker/Dockerfile.test_aiida index 1611291805..8513d059e2 100644 --- a/tools/docker/Dockerfile.test_aiida +++ b/tools/docker/Dockerfile.test_aiida @@ -23,7 +23,7 @@ COPY ./tools/toolchain/install_cp2k_toolchain.sh . RUN ./install_cp2k_toolchain.sh \ --install-all \ --mpi-mode=mpich \ - --with-dbcsr=no \ + --with-dbcsr \ --with-gcc=system \ --dry-run diff --git a/tools/docker/Dockerfile.test_ase b/tools/docker/Dockerfile.test_ase index 1632542072..1a4393b048 100644 --- a/tools/docker/Dockerfile.test_ase +++ b/tools/docker/Dockerfile.test_ase @@ -23,7 +23,7 @@ COPY ./tools/toolchain/install_cp2k_toolchain.sh . RUN ./install_cp2k_toolchain.sh \ --install-all \ --mpi-mode=mpich \ - --with-dbcsr=no \ + --with-dbcsr \ --with-gcc=system \ --dry-run diff --git a/tools/docker/Dockerfile.test_gromacs b/tools/docker/Dockerfile.test_gromacs index 510726991f..6bcdcfc76c 100644 --- a/tools/docker/Dockerfile.test_gromacs +++ b/tools/docker/Dockerfile.test_gromacs @@ -23,7 +23,7 @@ COPY ./tools/toolchain/install_cp2k_toolchain.sh . RUN ./install_cp2k_toolchain.sh \ --install-all \ --mpi-mode=mpich \ - --with-dbcsr=no \ + --with-dbcsr \ --with-gcc=system \ --dry-run diff --git a/tools/docker/Dockerfile.test_i-pi b/tools/docker/Dockerfile.test_i-pi index 59161dc0b8..7cea534519 100644 --- a/tools/docker/Dockerfile.test_i-pi +++ b/tools/docker/Dockerfile.test_i-pi @@ -23,7 +23,7 @@ COPY ./tools/toolchain/install_cp2k_toolchain.sh . RUN ./install_cp2k_toolchain.sh \ --install-all \ --mpi-mode=mpich \ - --with-dbcsr=no \ + --with-dbcsr \ --with-gcc=system \ --dry-run diff --git a/tools/docker/generate_dockerfiles.py b/tools/docker/generate_dockerfiles.py index 523bd6060c..466492f6ff 100755 --- a/tools/docker/generate_dockerfiles.py +++ b/tools/docker/generate_dockerfiles.py @@ -132,7 +132,7 @@ def main() -> None: for name in "aiida", "ase", "gromacs", "i-pi": with OutputFile(f"Dockerfile.test_{name}", args.check) as f: - f.write(install_deps_toolchain()) + f.write(install_deps_toolchain(with_dbcsr="")) f.write(test_3rd_party(name)) for name in "misc", "doxygen":