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Kde with openacc - #1461

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gtribello wants to merge 10 commits into
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kde-with-openacc
Open

gtribello wants to merge 10 commits into
masterfrom
kde-with-openacc

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@gtribello

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Description

This branch is trying to add the KDE action to the set of actions that can be parallelized on the GPU using OpenACC.

Target release

I would like my code to appear in release 2.11

Type of contribution
  • changes to code or doc authored by PLUMED developers, or additions of code in the core or within the default modules
  • changes to a module not authored by you
  • new module contribution or edit of a module authored by you
Copyright
  • I agree to transfer the copyright of the code I have written to the PLUMED developers or to the author of the code I am modifying.
  • the module I added or modified contains a COPYRIGHT file with the correct license information. Code should be released under an open source license. I also used the command cd src && ./header.sh mymodulename in order to make sure the headers of the module are correct.
Tests
  • I added a new regtest or modified an existing regtest to validate my changes.
  • I verified that all regtests are passed successfully on GitHub Actions.

@gtribello gtribello added the wip Do not merge label Sep 27, 2026
Comment thread src/gridtools/KDE.h Fixed
Comment thread plugins/openaccPTM/src/KDE.cpp Fixed
Comment thread plugins/openaccPTM/src/KDE.cpp Outdated
typedef KDE<DiagonalKernelParams,DiscreteKernel,KDEGridTools<DiagonalKernelParams,DiscreteKernel>,PLMD::ACCPTM> discretekde;
PLUMED_REGISTER_ACTION(discretekde,"KDE_DISCRETEACC")
typedef KDE<DiagonalKernelParams,HistogramBeadKernel,KDEGridTools<DiagonalKernelParams,HistogramBeadKernel>,PLMD::ACCPTM> beadkde;
PLUMED_REGISTER_ACTION(beadkde,"KDE_BEADS")
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2 participants