From b33d8a7f34b28f833c9d9e8b122eb2958edd0e24 Mon Sep 17 00:00:00 2001 From: Jakub Kropacek Date: Thu, 5 May 2022 20:39:38 +0200 Subject: [PATCH] modified: g/GROMACS/GROMACS-2022-fosscuda-2020b.eb --- g/GROMACS/GROMACS-2022-fosscuda-2020b.eb | 26 ++++++++++++------------ 1 file changed, 13 insertions(+), 13 deletions(-) diff --git a/g/GROMACS/GROMACS-2022-fosscuda-2020b.eb b/g/GROMACS/GROMACS-2022-fosscuda-2020b.eb index 9556612a..cb64782f 100644 --- a/g/GROMACS/GROMACS-2022-fosscuda-2020b.eb +++ b/g/GROMACS/GROMACS-2022-fosscuda-2020b.eb @@ -50,21 +50,21 @@ dependencies = [ # ('PLUMED', local_plum_ver), ] -exts_defaultclass = 'PythonPackage' +#exts_defaultclass = 'PythonPackage' -exts_default_options = { - 'source_urls': [PYPI_SOURCE], - 'use_pip': True, - 'download_dep_fail': True, - 'sanity_pip_check': True, -} +#exts_default_options = { +# 'source_urls': [PYPI_SOURCE], +# 'use_pip': True, +# 'download_dep_fail': True, +# 'sanity_pip_check': True, +#} -exts_list = [ - ('gmxapi', '0.2.0', { - 'preinstallopts': "export GMXTOOLCHAINDIR=%(installdir)s/share/cmake/gromacs_mpi && ", - 'checksums': ['3954bf123da12fc60bcfaeed8263f5e2d3e16e5136c2bb5c8207b20fa7406788'], - }), -] +#exts_list = [ +# ('gmxapi', '0.2.0', { +# 'preinstallopts': "export GMXTOOLCHAINDIR=%(installdir)s/share/cmake/gromacs_mpi && ", +# 'checksums': ['3954bf123da12fc60bcfaeed8263f5e2d3e16e5136c2bb5c8207b20fa7406788'], +# }), +#] modextrapaths = { 'PYTHONPATH': 'lib/python%(pyshortver)s/site-packages',