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Make CUDA the default compute platform
- #1576
#1576
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IAlibay
merged 12 commits into
main
OpenFreeEnergy/openfe:main
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default-cuda
OpenFreeEnergy/openfe:default-cuda
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Oct 20, 2025
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Make CUDA the default compute platform
#1576
IAlibay
merged 12 commits into
main
OpenFreeEnergy/openfe:main
from
default-cuda
OpenFreeEnergy/openfe:default-cuda
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Commits on Oct 14, 2025
Make CUDA the default compute platform
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Commits on Oct 17, 2025
Merge branch 'main' into default-cuda
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fix the MD protocol tests
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Add fixes for ahfes
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Add SepTop fixes
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Fixes for hyridtop
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Add test for compute platform
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rename fixture
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Deal with repeats for ahfe protocol
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review comments
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Commits on Oct 20, 2025
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Merge branch 'main' into default-cuda
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