Dear Christoph,
Many thanks for the response. I could somehow bypass the cmath error.
Unfortunately, I am getting stuck at the very next step of the compilation.
I am using the following options to compile the code.
prefix=/home/amondal/Programs/votca
version=master
git clone -b ${version} https://gitlab.mpcdf.mpg.de/votca/votca.git
cmake -B builddir -S votca -DCMAKE_INSTALL_PREFIX=${prefix}
-DEIGEN3_INCLUDE_DIR=/home/amondal/Programs/eigen3 -DBUILD_XTP=OFF
-DFFTW3_INCLUDE_DIR=/home/amondal/Programs/fftw-3.3.10/include
-DFFTW3_LIBRARY=/home/amondal/Programs/fftw-3.3.10/lib/libfftw3.so
-DEXPAT_INCLUDE_DIR=/home/amondal/Programs/expat-2.2.7/include
-DEXPAT_LIBRARY=/home/amondal/Programs/expat-2.2.7/lib
-DSQLITE3_INCLUDE_DIR=/home/amondal/Programs/sqlite/include
-DSQLITE3_LIBRARY=/home/amondal/Programs/sqlite/lib
-DGROMACS_INCLUDE_DIR=/home/amondal/Programs/gromacs/include
-DGROMACS_LIBRARY=/home/amondal/Programs/gromacs/lib64/libgromacs.so
The error I am getting is the following:
-- Checking for module 'libgromacs_d'
-- No package 'libgromacs_d' found
-- Checking for module 'libgromacs'
-- No package 'libgromacs' found
CMake Error at csg/CMakeModules/FindGROMACS.cmake:52 (message):
Could not find a suitable gromacs library. gmx_version is not defined in
the gromacs library, that is very very strange, take a look at the error
message in /home/amondal/Programs/builddir/CMakeFiles/CMakeError.log to
find out what was going wrong. This most likely means that your gromacs
version is too old, we need at least gromacs 2016!
Call Stack (most recent call first):
csg/CMakeLists.txt:85 (find_package)
I have manually checked the "libgromacs.so" and it is present in that
directory which is unfortunately not seen by cmake.
I would appreciate it if you can provide some ideas.
Thank you again,
Anirban
On Fri, Aug 12, 2022 at 6:58 PM Christoph Junghans <[email protected]>
wrote:
>
>
> On Fri, Aug 12, 2022 at 07:14 [email protected] <
> [email protected]> wrote:
>
>> Dear Developers,
>>
>> I am trying to install VOTCA on Mac OS Monterey V.12.5. I have all the
>> dependencies installed as per my understanding. Unfortunately, I get the
>> following error message early in building the code.
>>
>> -- Looking for C++ include cmath - not found
>> CMake Error at tools/CMakeLists.txt:127 (message):
>> Could not find needed header - cmath
>>
> If there is no cmath header you won’t be able to build VOTCA. I think
> Xcode has some C++ development environment that you need to install as well.
>
> Otherwise if you just want to use VOTCA with modifying the code, install
> docker for Mac and run the container:
> $ docker run -it votca/votca /bin/bash
>
> Christoph
>
>
>> For your reference, I am using GCC/C++ compilers (via Xcode). Below are
>> the options I am using.
>>
>> cmake -DBUILD_CSGAPPS=ON -DBUILD_CTP=ON -DBUILD_XTP=OFF
>> -DCMAKE_INSTALL_PREFIX=${prefix} -DBUILD_CTP_MANUAL=ON ..
>>
>> Please advise.
>> Thank you.
>> Anirban
>>
>> --
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>> .
>>
> --
> Christoph Junghans
> Web: http://www.compphys.de
>
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