GSOC 2020 PROJECT
MDAnalysis is a flexible and relatively fast framework for complex analysis tasks in molecular dynamics (MD) simulations. To achieve a flawless...
Description from the program archive
<p>MDAnalysis is a flexible and relatively fast framework for complex analysis tasks in molecular dynamics (MD) simulations. To achieve a flawless implementation of parallelism, I will implement serialization support for Universe, the core of MDAnalysis. Furthermore, I will adapt this new serialization functionality into Dask, multiprocessing, or MPI. Additionally, I will run tests, write documentation, and run benchmarks.</p>
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Claim this projectCédric BouyssetMentored by IAlibay, fiona-naughton, Richard Gowers
Hugo MacDermott-OpeskinMentored by Paul Bauer, Richard Gowers, orbeckst
Data: Google Summer of Code public archive. This project in the official archive
