Thank you sir for reply. I complie the amber using cuda 11.0 and property
installed
On Thu, 28 Dec, 2023, 3:45 pm K A SIVASANKER, <ka.sivasanker.ncl.res.in>
wrote:
> Dear Mondal,
> Error 2 is due to the some problem in the installing case.Actually actual
> error is in error 1.I also hads similiar issue.I solved it installing using
> old configure(using older version of cuda 11.1 or lower) rather than the
> new bulit or try to install it with miniconda.
>
> Regards,
>
> Sivasanker K A
> NCL ID-12183
> c/o Dr. Kumar Vanka
> Physical & Material Chemistry
> CSIR NCL Pune
>
> ----- Original Message -----
> From: amber.ambermd.org
> To: amber.ambermd.org
> Sent: Wednesday, December 27, 2023 2:48:52 PM
> Subject: [AMBER] amber22 installation error
>
> Dear Experts,
> I am trying to install amber22 in cuda. I do the following steps.
>
> module load module load compiler/gcc/8.3.0 compiler/cmake/3.15.4
> compiler/cuda/11.2
>
> I edit the run cmake file.
>
> Assume this is Linux:
>
> cmake $AMBER_PREFIX/amber22_src \
> -DCMAKE_INSTALL_PREFIX=$AMBER_PREFIX/amber22 \
> -DCOMPILER=GNU -DUSE_CONDA_LIBS=TRUE -DFORCE_INTERNAL_LIBS=arpack \
> -DMPI=FALSE -DCUDA=TRUE -DINSTALL_TESTS=TRUE \
> -DDOWNLOAD_MINICONDA=FALSE \
> 2>&1 | tee cmake.log
> make install.
>
> But after 82 %, the installation is stopped.
>
> r/pbsa.cuda_generated_cusp_LinearSolvers.cu.o
> [ 83%] Building NVCC (Device) object
>
> AmberTools/src/pbsa/CMakeFiles/pbsa.cuda.dir/pbsa.cuda_generated_cusparse_LinearSolvers.cu.o
>
> /home/21cy91r03/amber22_src/AmberTools/src/pbsa/cusparse_LinearSolvers.cu(82):
> error: identifier "CUSPARSE_SPMV_ALG_DEFAULT" is undefined
>
>
> /home/21cy91r03/amber22_src/AmberTools/src/pbsa/cusparse_LinearSolvers.cu(236):
> error: identifier "CUSPARSE_SPMV_ALG_DEFAULT" is undefined
>
> 2 errors detected in the compilation of
>
> "/home/21cy91r03/amber22_src/AmberTools/src/pbsa/cusparse_LinearSolvers.cu".
> CMake Error at
> pbsa.cuda_generated_cusparse_LinearSolvers.cu.o.RELEASE.cmake:277
> (message):
> Error generating file
>
>
> /home/21cy91r03/amber22_src/build/AmberTools/src/pbsa/CMakeFiles/pbsa.cuda.dir//./pbsa.cuda_generated_cusparse_LinearSolvers.cu.o
>
>
> make[2]: ***
>
> [AmberTools/src/pbsa/CMakeFiles/pbsa.cuda.dir/pbsa.cuda_generated_cusparse_LinearSolvers.cu.o]
> Error 1
> make[1]: *** [AmberTools/src/pbsa/CMakeFiles/pbsa.cuda.dir/all] Error 2
> make: *** [all] Error 2
> --
> *With regards,*
> *Dulal Mondal,*
> *Research Scholar,*
> *Department of Chemistry,*
> *IIT Kharagpur, Kharagpur 721302.*
> _______________________________________________
> AMBER mailing list
> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber
>
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Received on Thu Dec 28 2023 - 08:00:02 PST
