[gmx-users] gromacs installing problems with "cmake .."

Mark Abraham mark.j.abraham at gmail.com
Mon Feb 6 14:52:55 CET 2017


Hi,

You need a C++ compiler on your system, e.g.
http://askubuntu.com/questions/689722/how-to-install-a-c-c-compiler-in-ubuntu-14-04lts

Mark

On Mon, 6 Feb 2017 14:12 Zhang, Cheng <c.zhang.11 at ucl.ac.uk> wrote:

Dear Gromacs users,

I got a list of errors after running "cmake ..". I am sure the "cmake"
itself is already installed. I am installing Gromacs 5.1.4 on
ubuntu-14.04.1 on VMwarePlayer on a Dell PC. Can I ask how to solve this?


Thank you.

Yours sincerely

Cheng


ucbepan at ubuntu:/mnt/hgfs/Documents/gromacs-5.1.4/build$ cmake ..
-DGMX_BUILD_OWN_FFTW=ON -DREGRESSIONTEST_DOWNLOAD=ON
-- The CXX compiler identification is unknown
CMake Error: your CXX compiler: "CMAKE_CXX_COMPILER-NOTFOUND" was not
found.   Please set CMAKE_CXX_COMPILER to a valid compiler path or name.
-- No compatible CUDA toolkit found (v4.0+), disabling native GPU
acceleration
CMake Warning at cmake/gmxTestCompilerProblems.cmake:41 (message):
  The ids of the C and C++ compilers do not match (GNU and , respectively).
  Mixing different C/C++ compilers can cause problems.
Call Stack (most recent call first):
  CMakeLists.txt:310 (gmx_test_compiler_problems)


CMake Warning at cmake/gmxTestCompilerProblems.cmake:44 (message):
  The versions of the C and C++ compilers do not match (4.8.2 and ,
  respectively).  Mixing different C/C++ compilers can cause problems.
Call Stack (most recent call first):
  CMakeLists.txt:310 (gmx_test_compiler_problems)


CMake Error at cmake/gmxManageSimd.cmake:67 (message):
  Cannot find AVX compiler flag.  Use a newer compiler, or choose SSE4.1
SIMD
  (slower).
Call Stack (most recent call first):
  cmake/gmxManageSimd.cmake:261
(gmx_give_fatal_error_when_simd_support_not_found)
  CMakeLists.txt:648 (gmx_manage_simd)


-- Configuring incomplete, errors occurred!
See also
"/mnt/hgfs/Documents/gromacs-5.1.4/build/CMakeFiles/CMakeOutput.log".
See also
"/mnt/hgfs/Documents/gromacs-5.1.4/build/CMakeFiles/CMakeError.log".
--
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