Yes. the compiler is correct. However the system is centos 6.9 and it is pretty old and I am sure I will face further problems.So, I have to change the system.Anyway, thanks.
Regards, Mahmood On Sunday, November 3, 2019, 10:43:44 AM GMT+3:30, David van der Spoel <sp...@xray.bmc.uu.se> wrote: Den 2019-11-02 kl. 14:25, skrev Mahmood Naderan: > Hi, > Although I have specified a custom CC and CXX path, the cmake command fails > with an error. > > $ cmake .. -DGMX_GPU=on -DCMAKE_INSTALL_PREFIX=../single61 > -DGMX_BUILD_OWN_FFTW=ON -DGMX_CUDA_TARGET_SM=61 > -DCMAKE_C_COMPILER=/home/mahmood/tools/gcc-6.1.0/bin/gcc > -DCMAKE_CXX_COMPILER=/home/mahmood/tools/gcc-6.1.0/bin/g++-- The C compiler > identification is unknown > -- The CXX compiler identification is unknown > -- Check for working C compiler: /home/mahmood/tools/gcc-6.1.0/bin/gcc-- > Check for working C compiler: /home/mahmood/tools/gcc-6.1.0/bin/gcc -- > brokenCMake Error at > /home/mahmood/tools/cmake-3.15.4/share/cmake-3.15/Modules/CMakeTestCCompiler.cmake:60 > (message): The C compiler > > "/home/mahmood/tools/gcc-6.1.0/bin/gcc" > is not able to compile a simple test program. Have you verified that the compiler is installed correctly, e.g. by compiling a small test program? Is /home/mahmood/tools/gcc-6.1.0/bin/ in your PATH? > > It fails with the following output: > > Change Dir: >/home/mahmood/cactus/gromacs/gromacs-2019.4/build/CMakeFiles/CMakeTmp > Run Build Command(s):/usr/bin/gmake cmTC_68dcc/fast && /usr/bin/gmake -f >CMakeFiles/cmTC_68dcc.dir/build.make CMakeFiles/cmTC_68dcc.dir/build > gmake[1]: Entering directory >`/home/mahmood/cactus/gromacs/gromacs-2019.4/build/CMakeFiles/CMakeTmp' >Building C object CMakeFiles/cmTC_68dcc.dir/testCCompiler.c.o > /home/mahmood/tools/gcc-6.1.0/bin/gcc -o >CMakeFiles/cmTC_68dcc.dir/testCCompiler.c.o -c >/home/mahmood/cactus/gromacs/gromacs-2019.4/build/CMakeFiles/CMakeTmp/testCCompiler.c > /home/mahmood/tools/gcc-6.1.0/libexec/gcc/x86_64-pc-linux-gnu/6.1.0/cc1: >error while loading shared libraries: libmpc.so.3: cannot open shared object >file: No such file or directory gmake[1]: *** >[CMakeFiles/cmTC_68dcc.dir/testCCompiler.c.o] Error 1 > gmake[1]: Leaving directory >`/home/mahmood/cactus/gromacs/gromacs-2019.4/build/CMakeFiles/CMakeTmp' >gmake: *** [cmTC_68dcc/fast] Error 2 > > > > CMake will not be able to correctly generate this project. > Call Stack (most recent call first): > CMakeLists.txt:41 (project) > > > -- Configuring incomplete, errors occurred! > See also > "/home/mahmood/cactus/gromacs/gromacs-2019.4/build/CMakeFiles/CMakeOutput.log".See > also > "/home/mahmood/cactus/gromacs/gromacs-2019.4/build/CMakeFiles/CMakeError.log". > However, the path is correct > > > $ /home/mahmood/tools/gcc-6.1.0/bin/gcc -vUsing built-in specs. > COLLECT_GCC=/home/mahmood/tools/gcc-6.1.0/bin/gccCOLLECT_LTO_WRAPPER=/home/mahmood/tools/gcc-6.1.0/libexec/gcc/x86_64-pc-linux-gnu/6.1.0/lto-wrapperTarget: > x86_64-pc-linux-gnu > Configured with: ./configure --prefix=/home/mahmood/tools/gcc-6.1.0 > --disable-multilib --enable-languages=c,c++Thread model: posix > gcc version 6.1.0 (GCC) > > > > Any idea about that? > > Regards, > Mahmood > -- David van der Spoel, Ph.D., Professor of Biology Head of Department, Cell & Molecular Biology, Uppsala University. Box 596, SE-75124 Uppsala, Sweden. Phone: +46184714205. http://www.icm.uu.se -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org. -- Gromacs Users mailing list * Please search the archive at http://www.gromacs.org/Support/Mailing_Lists/GMX-Users_List before posting! * Can't post? Read http://www.gromacs.org/Support/Mailing_Lists * For (un)subscribe requests visit https://maillist.sys.kth.se/mailman/listinfo/gromacs.org_gmx-users or send a mail to gmx-users-requ...@gromacs.org.