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GROMACS
GROMACS
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Created date
Used GoogleTest skip and failure mechanisms to manage NbnxmTests
!4254
· created
Apr 17, 2024
by
Mark Abraham
2025.devcycle2
testing
2 of 3 Approvals
2
updated
Apr 17, 2024
Fix DeviceContext::activate issue found in nvshmem test
!4253
· created
Apr 17, 2024
by
Mark Abraham
Merged
Approved
2
updated
Apr 17, 2024
Draft: oneMKL: Use modern descriptor parameters (since MKL 2024.1)
!4252
· created
Apr 16, 2024
by
Andrey Alekseenko
0 of 3 Approvals
0
updated
Apr 17, 2024
Docs: fix the description of PME offload limitations
!4251
· created
Apr 16, 2024
by
Andrey Alekseenko
release-2024
SYCL
documentation
0 of 3 Approvals
0
updated
Apr 16, 2024
Use GTEST_SKIP in Nbnxn tests
!4250
· created
Apr 16, 2024
by
Mark Abraham
2025.devcycle2
Merged
Approved
0
updated
Apr 16, 2024
Suppress clang tidy
!4249
· created
Apr 16, 2024
by
Mark Abraham
Merged
Approved
1
updated
Apr 16, 2024
Add documentation for GMX_USE_NVTX and friends
!4248
· created
Apr 15, 2024
by
Andrey Alekseenko
release-2024
documentation
Merged
Approved
1
updated
Apr 16, 2024
Draft: Diagonalization of asymmetric matrices by the eigensolver
!4247
· created
Apr 15, 2024
by
Cathrine Bergh
0 of 3 Approvals
0
updated
Apr 15, 2024
Fix DLB with IMPI + dpcpp + Intel GPUs
!4246
· created
Apr 15, 2024
by
Mark Abraham
0 of 3 Approvals
8
updated
Apr 17, 2024
Remove raw pmalloc methods
!4245
· created
Apr 15, 2024
by
Paul Bauer
0 of 3 Approvals
0
updated
Apr 15, 2024
Add HIP device buffer implementation
!4244
· created
Apr 15, 2024
by
Paul Bauer
2025.devcycle2
4954-add-hip-gpu_utils
AMD HIP
Feature
GPU acceleration
0
updated
Apr 16, 2024
Add gpu_utils implementation for HIP
!4243
· created
Apr 15, 2024
by
Paul Bauer
2025.devcycle2
AMD HIP
Feature
GPU acceleration
0 of 3 Approvals
15
updated
Apr 17, 2024
Removed mention of and workaround for 32-bit x86
!4242
· created
Apr 12, 2024
by
Vedran Miletić
review-effort
low
Merged
Approved
5
updated
Apr 16, 2024
Fix backup for Colvars output files
!4241
· created
Apr 12, 2024
by
Giacomo Fiorin
2024.2
release-2024
Colvars
0 of 3 Approvals
1
4
updated
Apr 18, 2024
Test that computeEffectiveAtomDensity correctly handles large negative coordinates.
!4240
· created
Apr 12, 2024
by
Andrey Alekseenko
testing
Merged
Approved
1
updated
Apr 12, 2024
Allow compiling for HIP backend with other host compilers
!4239
· created
Apr 12, 2024
by
Paul Bauer
0 of 3 Approvals
0
updated
Apr 15, 2024
Fix nightly manual upload path
!4238
· created
Apr 12, 2024
by
Paul Bauer
Merged
Approved
5
updated
Apr 12, 2024
Use correct user to upload nightly doc builds
!4237
· created
Apr 11, 2024
by
Paul Bauer
Merged
Approved
1
updated
Apr 12, 2024
Revert "Remove webpage upload from release branch"
!4236
· created
Apr 11, 2024
by
Paul Bauer
Merged
Approved
2
updated
Apr 11, 2024
Make HostAllocationPolicy more flexible
!4235
· created
Apr 11, 2024
by
Mark Abraham
GPU acceleration
0 of 3 Approvals
3
updated
Apr 16, 2024
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