madscatt / zazzie

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GNU General Public License v3.0
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Evaluate ZAZZIE extensions for Python 3 conversion #138

Closed madscatt closed 1 year ago

madscatt commented 1 year ago

Set up a sandbox and carry out the evaluation to determine which, if any, modules are not going to easily converted to Python 3. Start with the simple extensions and move towards GPU (SasCalc) and MPI codes (BEES and P(r)).

madscatt commented 1 year ago

Sascalc extensions (both extensions/ and sascalc_api_extension.cpp) can be compiled using Python 3.9.12.

madscatt commented 1 year ago

SasMol (zazmol) is now updated to python 3. There shouldn't be an issue with BEES and P(r), but they will be converted as development progresses so this issue will be closed.