diff --git a/Golden_Repo/a/AMBER/AMBER-20-gpsmkl-2020.eb b/Golden_Repo/a/AMBER/AMBER-20-gpsmkl-2020.eb index 274548aae63c3849c663d8b6d7a131af7a94bc3f..6376a70c9dc9981a13f57d2a6604063fff3f8337 100644 --- a/Golden_Repo/a/AMBER/AMBER-20-gpsmkl-2020.eb +++ b/Golden_Repo/a/AMBER/AMBER-20-gpsmkl-2020.eb @@ -32,13 +32,14 @@ builddependencies = [ ('binutils', '2.34',), ] dependencies = [ -# ('CMake', '3.18.0'), + # ('CMake', '3.18.0'), ('FFTW', '3.3.8'), ('Python', '3.8.5'), - ('SciPy-Stack', '2020', '-Python-%(pyver)s', ('gcccoremkl', '9.3.0-2020.2.254')), - ('Boost', '1.74.0','-nompi'), + ('SciPy-Stack', '2020', '-Python-%(pyver)s', + ('gcccoremkl', '9.3.0-2020.2.254')), + ('Boost', '1.74.0', '-nompi'), ('flex', '2.6.3'), - ('NCCL','2.8.3-1','-CUDA-11.0'), + ('NCCL', '2.8.3-1', '-CUDA-11.0'), ] # Something in the source is causing flex 2.6.4 to SEGFAULT. Keep it at 2.6.3 # until it is fixed. /SM 2021-05-13 @@ -84,5 +85,3 @@ access please see: ''' moduleclass = 'bio' - -