Dear Amber Support Team,
I hope this message finds you well.
I am currently trying to compile Amber 24 on my system, but I am encountering an issue during the compilation of CUDA-related files. Specifically, I am seeing the following error:
make[1]: *** [CMakeFiles/Makefile2:2672: src/pmemd/src/cuda/CMakeFiles/pmemd_cuda_DPFP.dir/all] Error 2
make[1]: *** [CMakeFiles/Makefile2:2698: src/pmemd/src/cuda/CMakeFiles/pmemd_cuda_DPFP_mpi.dir/all] Error 2
make: *** [Makefile:156: all] Error 2
I am using CUDA version 12.0 (as confirmed by nvcc --version), which is shown below:
nvcc: NVIDIA (R) Cuda compiler driver
Copyright (c) 2005-2023 NVIDIA Corporation
Built on Fri_Jan__6_16:45:21_PST_2023
Cuda compilation tools, release 12.0, V12.0.140
Build cuda_12.0.r12.0/compiler.32267302_0
Could you please help me understand why this error is occurring and suggest possible solutions? Any insights regarding potential compatibility issues with CUDA 12.0 or configuration errors would be greatly appreciated.
Thank you for your time and assistance.
Dear Amber Support Team,
I hope this message finds you well.
I am currently trying to compile Amber 24 on my system, but I am encountering an issue during the compilation of CUDA-related files. Specifically, I am seeing the following error:
make[1]: *** [CMakeFiles/Makefile2:2672: src/pmemd/src/cuda/CMakeFiles/pmemd_cuda_DPFP.dir/all] Error 2
make[1]: *** [CMakeFiles/Makefile2:2698: src/pmemd/src/cuda/CMakeFiles/pmemd_cuda_DPFP_mpi.dir/all] Error 2
make: *** [Makefile:156: all] Error 2
I am using CUDA version 12.0 (as confirmed by nvcc --version), which is shown below:
nvcc: NVIDIA (R) Cuda compiler driver
Copyright (c) 2005-2023 NVIDIA Corporation
Built on Fri_Jan__6_16:45:21_PST_2023
Cuda compilation tools, release 12.0, V12.0.140
Build cuda_12.0.r12.0/compiler.32267302_0
Could you please help me understand why this error is occurring and suggest possible solutions? Any insights regarding potential compatibility issues with CUDA 12.0 or configuration errors would be greatly appreciated.
Thank you for your time and assistance.