[AMBER] Amber 12 GTX-980

From: Sarah Graham <sarahgra.umich.edu>
Date: Thu, 21 Jan 2016 10:07:48 -0500


I'm trying to get Amber 12 to work with GTX-980, and wondering if anyone
has been successful with this?

Our system admin tried following the advice given previously
but got the error message shown below.
Thanks in advance,


/usr/local/cuda/bin/nvcc -use_fast_math -O0 -gencode
arch=compute_13,code=sm_13 -gencode arch=compute_20,code=sm_20 -gencode
arch=compute_30,code=sm_30 -gencode arch=compute_35,code=sm_35 -gencode
arch=compute_37,code=sm_37 -gencode arch=compute_50,code=sm_50 -DCUDA
-Duse_SPFP -I/usr/local/cuda/include -IB40C -IB40C/KernelCommon -c

nvcc warning : The 'compute_11', 'compute_12', 'compute_13', 'sm_11',
'sm_12', and 'sm_13' architectures are deprecated, and may be removed in a
future release.

ptxmacros.h(69): error: function "__shfl(unsigned int, int, int)" has
already been defined

ptxmacros.h(100): error: function "__shfl(double, int, int)" has already
been defined

2 errors detected in the compilation of

make[4]: *** [kForcesUpdate.o] Error 2

make[4]: Leaving directory `/users/amber12_x64/amber12/src/pmemd/src/cuda'

make[3]: *** [cuda/cuda.a] Error 2

make[3]: Leaving directory `/users/amber12_x64/amber12/src/pmemd/src'

make[2]: *** [cuda] Error 2

make[2]: Leaving directory `/users/amber12_x64/amber12/src/pmemd'

make[1]: *** [cuda] Error 2

make[1]: Leaving directory `/users/amber12_x64/amber12/src'
make: *** [install] Error 2
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Received on Thu Jan 21 2016 - 07:30:03 PST
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