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LeMonADE - Interaction

This repo is concerned with the simulation of systems with a pairwise interaction.

Authors

Seed Authors

Installation

  1. Install LeMonADE from the develop branch of https://github.com/LeMonADE-project/LeMonADE.git.
  2. Install LEMonADE-GPU from the master branch of https://github.com/LeMonADE-project/LeMonADE-GPU.git.
  3. Execute the 'configure' script with the following options:
  • -DLEMONADE_DIR=/path/to/LeMonADE-Installation/
  • -DLEMONADEGPU_DIR=/path/to/LeMonADEGPU-Installation/
  • -DCUDA_ARCH=Compute_Capability_For_GPU
  • -DBUILDDIR=/build/directory/ Default is ./build
  • -DLEMONADE_TESTS=ON/OFF Default is :OFF
  • -DCMAKE_BUILD_TYPE=Release/Debug Default is : Release For the most cases the default is enough and one needs to execute:
 ./configure -DLEMONADE_DIR=/path/to/LeMonADE-Installation/
  1. Compile the project by executing
  make

Compute capability can be found in : https://developer.nvidia.com/cuda-gpus

How to use it?

  • The CommandLineParser is a simple way to hand over parameters to the program. There are several alternative like the Boost library ( see tutorial) or the native iostream library in cpp.
  • Here the catch2 testsuit is used. See the homepage for further information how to use it.

License

See LeMonADE-license