Nikita Tretyakov
Nikita Tretyakov
Hi Andreas, I'm building ESPResSo++ in Garching loading the following modules: `module load cmake/3.10` `module load intel/18.0` `module load mkl/2018.2` `module load impi/2018.2` `module load fftw-mpi/3.3.7` `module load anaconda/2/5.1` `module...
@henkela we wanted a way to be compatible with both, so the type `real` was introduced. But ever since we used double precision. So, behind `real` is actually `double`
@henkela sorry, the `fftw-mpi/3.3.7` was actually commented out, so only the serial one was loaded. `anaconda` was loaded for python and `numpy` compatibility (some io stuff depends on this). And...
@henkela > How is mkl picked up? Probably I just didn’t see it in the CMakeFiles... mkl is not loaded on the c++ level, but on the python one, speeding...
these things can be moved to `examples`, as there is no real testing (the test framework with assert is not used at all). @acfogarty ?
I think for `pi_water` it is even not possible. At least I haven't seen this possibility. There `psfwrite` takes quite some time
I support this question.
Ok, I do understand now that the idea behind is to check the code a bit and prevent broken master through testing. But weren't these compilation tests there also before...
As @acfogarty mentioned, we discuss here what conditions have to be met by pull requests. As soon as the final version is clear, I'll start to put it on wiki...
1. Laptop 2. There are many things running, but i can track singular processes 3. Yes, I'm sure. If I comment fastwritexyz the memory does not grow. Interestingly, only the...