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-rw-r--r--var/spack/repos/builtin/packages/gromacs/package.py20
1 files changed, 7 insertions, 13 deletions
diff --git a/var/spack/repos/builtin/packages/gromacs/package.py b/var/spack/repos/builtin/packages/gromacs/package.py
index 8611dc2026..d079188db6 100644
--- a/var/spack/repos/builtin/packages/gromacs/package.py
+++ b/var/spack/repos/builtin/packages/gromacs/package.py
@@ -25,7 +25,7 @@
from spack import *
-class Gromacs(Package):
+class Gromacs(CMakePackage):
"""GROMACS (GROningen MAchine for Chemical Simulations) is a molecular
dynamics package primarily designed for simulations of proteins, lipids
and nucleic acids. It was originally developed in the Biophysical
@@ -64,28 +64,22 @@ class Gromacs(Package):
if '+plumed' in self.spec:
self.spec['plumed'].package.apply_patch(self)
- def install(self, spec, prefix):
+ def cmake_args(self):
options = []
- if '+mpi' in spec:
+ if '+mpi' in self.spec:
options.append('-DGMX_MPI:BOOL=ON')
- if '+double' in spec:
+ if '+double' in self.spec:
options.append('-DGMX_DOUBLE:BOOL=ON')
- if '~shared' in spec:
+ if '~shared' in self.spec:
options.append('-DBUILD_SHARED_LIBS:BOOL=OFF')
- if '+debug' in spec:
+ if '+debug' in self.spec:
options.append('-DCMAKE_BUILD_TYPE:STRING=Debug')
else:
options.append('-DCMAKE_BUILD_TYPE:STRING=Release')
- options.extend(std_cmake_args)
-
- with working_dir('spack-build', create=True):
-
- cmake('..', *options)
- make()
- make('install')
+ return options