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soapxx

Installation

git clone https://github.com/capoe/soapxx.git
cd soapxx
git clone https://github.com/pybind/pybind11.git
./build.sh --install_boost
source soap/SOAPRC

Dependencies

  • MKL (+ Intel compilers recommended)
  • Python packages: numpy, scipy, h5py

Notes

If build.sh is executed with the --install_boost option, the build process includes a partial local installation of Boost 1.54.0 (components: python, serialization). You can omit this option if you already have Boost version < 1.67 installed on your system. Subsequent builds should be run without this option, unless reinstalling Boost is explicitly desired (e.g., due to a compiler change).