diff options
Diffstat (limited to 'var/spack/repos/builtin/packages/turbomole/package.py')
| -rw-r--r-- | var/spack/repos/builtin/packages/turbomole/package.py | 43 |
1 files changed, 17 insertions, 26 deletions
diff --git a/var/spack/repos/builtin/packages/turbomole/package.py b/var/spack/repos/builtin/packages/turbomole/package.py index fc331a1429..0c996fcf18 100644 --- a/var/spack/repos/builtin/packages/turbomole/package.py +++ b/var/spack/repos/builtin/packages/turbomole/package.py @@ -52,9 +52,8 @@ class Turbomole(Package): return def install(self, spec, prefix): - if spec.satisfies('@:7.0.2'): - calculate_version = 'calculate_2.4_linux64' - molecontrol_version = 'MoleControl_2.5' + calculate_version = 'calculate_2.4_linux64' + molecontrol_version = 'MoleControl_2.5' tm_arch = self.get_tm_arch() @@ -114,33 +113,25 @@ class Turbomole(Package): install('mpirun_scripts/ricc2', join_path(dst, 'mpirun_scripts')) install('mpirun_scripts/ridft', join_path(dst, 'mpirun_scripts')) - def setup_environment(self, spack_env, run_env): - if self.spec.satisfies('@:7.0.2'): - molecontrol_version = 'MoleControl_2.5' + def setup_run_environment(self, env): + molecontrol_version = 'MoleControl_2.5' tm_arch = self.get_tm_arch() - run_env.set('TURBODIR', join_path(self.prefix, 'TURBOMOLE')) - run_env.set('MOLE_CONTROL', - join_path(self.prefix, 'TURBOMOLE', molecontrol_version)) + env.set('TURBODIR', self.prefix.TURBOMOLE) + env.set('MOLE_CONTROL', + join_path(self.prefix, 'TURBOMOLE', molecontrol_version)) - run_env.prepend_path('PATH', - join_path(self.prefix, 'TURBOMOLE', 'thermocalc')) - run_env.prepend_path('PATH', - join_path(self.prefix, 'TURBOMOLE', 'scripts')) + env.prepend_path('PATH', self.prefix.TURBOMOLE.thermocalc) + env.prepend_path('PATH', self.prefix.TURBOMOLE.scripts) if '+mpi' in self.spec: - run_env.set('PARA_ARCH', 'MPI') - run_env.prepend_path('PATH', - join_path(self.prefix, - 'TURBOMOLE', 'bin', '%s_mpi' - % tm_arch)) + env.set('PARA_ARCH', 'MPI') + env.prepend_path('PATH', join_path( + self.prefix, 'TURBOMOLE', 'bin', '%s_mpi' % tm_arch)) elif '+smp' in self.spec: - run_env.set('PARA_ARCH', 'SMP') - run_env.prepend_path('PATH', - join_path(self.prefix, - 'TURBOMOLE', 'bin', '%s_smp' - % tm_arch)) + env.set('PARA_ARCH', 'SMP') + env.prepend_path('PATH', join_path( + self.prefix, 'TURBOMOLE', 'bin', '%s_smp' % tm_arch)) else: - run_env.prepend_path('PATH', - join_path(self.prefix, - 'TURBOMOLE', 'bin', tm_arch)) + env.prepend_path('PATH', join_path( + self.prefix, 'TURBOMOLE', 'bin', tm_arch)) |