Docker: Re-Enable torch, ace, and greenX for sdbg build

cmake/cmake_cp2k.sh

@@ -79,20 +79,12 @@ elif [[ "${PROFILE}" == "toolchain_all" ]] && [[ "${VERSION}" == "pdbg" ]]; then
   CMAKE_EXIT_CODE=$?
 
 elif [[ "${PROFILE}" == "toolchain_all" ]] && [[ "${VERSION}" == "sdbg" ]]; then
-  # TODO Re-enable LIBTORCH and ACE. For some reason they currently lead to a
-  # floating-point exception in `fit_and_continuation_2pole()` at rpa_gw.F:3979.
-  #
-  # TODO Re-enable GREENX. It currently leads to a floating-point exception
-  # in `greenx_get_minimax_grid()` at greenx_interface.F:314.
   cmake \
     -GNinja \
     -DCMAKE_BUILD_TYPE="Debug" \
     -DCMAKE_INSTALL_PREFIX="${INSTALL_PREFIX}" \
     -DCP2K_USE_EVERYTHING=ON \
     -DCP2K_USE_MPI=OFF \
-    -DCP2K_USE_LIBTORCH=OFF \
-    -DCP2K_USE_ACE=OFF \
-    -DCP2K_USE_GREENX=OFF \
     -Werror=dev \
     .. |& tee ./cmake.log
   CMAKE_EXIT_CODE=$?

src/CMakeLists.txt

@@ -1717,7 +1717,6 @@ target_link_libraries(
     $<$<AND:$<BOOL:${CP2K_USE_FFTW3_}>,$<BOOL:${CP2K_ENABLE_FFTW3_OPENMP_SUPPORT}>>:cp2k::FFTW3::fftw3_omp>
     $<$<BOOL:${CP2K_USE_SPLA}>:SPLA::spla>
     $<$<BOOL:${CP2K_USE_LIBINT2}>:cp2k::Libint2::int2>
-    $<$<BOOL:${CP2K_USE_LIBTORCH}>:${TORCH_LIBRARIES}>
     $<$<BOOL:${CP2K_USE_COSMA}>:cosma::cosma_prefixed_pxgemm>
     $<$<BOOL:${CP2K_USE_COSMA}>:cosma::cosma>
     $<$<BOOL:${CP2K_USE_DLAF}>:DLAF::Fortran>
@@ -1730,6 +1729,8 @@ target_link_libraries(
     DBCSR::dbcsr
     $<$<BOOL:${CP2K_USE_MPI}>:cp2k::SCALAPACK::scalapack>
     cp2k_linalg_libs
+    # Torch includes some LAPACK routines, but with floating-point exceptions.
+    $<$<BOOL:${CP2K_USE_LIBTORCH}>:${TORCH_LIBRARIES}>
     $<$<AND:$<CONFIG:COVERAGE>,$<Fortran_COMPILER_ID:GNU>>:gcov>)
 
 string(TIMESTAMP CP2K_TIMESTAMP "%Y-%m-%d %H:%M:%S")