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View Code? Open in Web Editor NEWMassively parallel hybrid particle-field molecular dynamics (hPF-MD) simulation method in Julia
License: MIT License
Massively parallel hybrid particle-field molecular dynamics (hPF-MD) simulation method in Julia
License: MIT License
hPF-MD.jl => RobertoMD.jl due to the naming policy of Julia general package.
The roadmap below was originally intended to write a toy code for testing new algorithms based on the particle field scheme.
The goal of this package is now to become a production simulator for particle-field simulations, since the performance of Julia and the parallelization capability of MPI.jl are quite satisfactory.
The support force-fields are limited. Next tasks will be implementations of:
Improvements of hPF-MD.jl:
Future work of hPF-MD method:
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