Hi All,
I am trying to install the Amber20 in centos 7 and getting below error. Anyone can help me to solve the issue
[schrogpu1 build]$ sudo ./run_cmake1
-- **************************************************************************
-- Starting configuration of Amber version 20.0.0...
-- CMake Version: 3.8.2
-- For how to use this build system, please read this wiki:
--
http://ambermd.org/pmwiki/pmwiki.php/Main/CMake
-- For a list of important CMake variables, check here:
--
http://ambermd.org/pmwiki/pmwiki.php/Main/CMake-Common-Options
-- **************************************************************************
-- Amber source found, building AmberTools and Amber
-- Could NOT find MPI_C (missing: MPI_C_LIBRARIES MPI_C_INCLUDE_PATH)
-- Could NOT find MPI_CXX (missing: MPI_CXX_LIBRARIES MPI_CXX_INCLUDE_PATH)
-- Could NOT find MPI_Fortran (missing: MPI_Fortran_LIBRARIES MPI_Fortran_INCLUDE_PATH)
CMake Error at cmake/MPIConfig.cmake:12 (message):
You requested MPI, but the MPI C library was not found. Please install one
and try again, or set MPI_C_INCLUDE_PATH and MPI_C_LIBRARIES to point to
your MPI.
Call Stack (most recent call first):
CMakeLists.txt:118 (include)
-- Configuring incomplete, errors occurred!
See also "/data/amber20_src/build/CMakeFiles/CMakeOutput.log".
See also "/data/amber20_src/build/CMakeFiles/CMakeError.log".
If the cmake build report looks OK, you should now do the following:
make install
source /data/amber20/amber.sh
Consider adding the last line to your login startup script, e.g. ~/.bashrc
Regards
Suguna
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Received on Thu Dec 02 2021 - 11:30:02 PST
