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Commits
: Listings
Analyzed
12 months
ago. based on code collected
12 months
ago.
Jan 16, 2023 — Jan 16, 2024
Showing page 11 of 17
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Date
Fix mdrun segfault when perturbing only LJ-14 parameters
Berk Hess
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over 1 year ago
Merge release-2023 into main
Andrey Alekseenko
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over 1 year ago
Add MDModulesAtomsRedistributedSignal
Berk Hess
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over 1 year ago
CI: Update oneAPI CI image
Andrey Alekseenko
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over 1 year ago
OpenCL: Fix resource leak in clearDeviceBufferAsync
Andrey Alekseenko
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over 1 year ago
Bump bundled lmfit to 9.0
Andrey Alekseenko
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over 1 year ago
Fix the formatting of 2023.2 release notes
Andrey Alekseenko
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over 1 year ago
Improve new and old XTC safety and testability
Erik Lindahl
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over 1 year ago
Increase and check for limits of mdrun output files
Berk Hess
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over 1 year ago
Support and test client build against hipSYCL installation.
M. Eric Irrgang
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over 1 year ago
Add a MDModule notification for ensemble temperature
Hubert Santuz
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over 1 year ago
Remove "regressiontests/rotation" from "make check"
Andrey Alekseenko
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over 1 year ago
Get rid of DeviceAccessor wrapper, use raw pointers
Andrey Alekseenko
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over 1 year ago
Only print ensemble temperature when constant
Berk Hess
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over 1 year ago
OpenCL: Add missing clFlush to GpuEventSynchronizerTest.BasicFunctionality
Andrey Alekseenko
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over 1 year ago
Fix ensemble temperature with annealing and mult. T-groups
Berk Hess
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over 1 year ago
Initialize memory in gmx hbond
Berk Hess
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over 1 year ago
Extract NBNxM generateAndFill2DGrid()
Berk Hess
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over 1 year ago
SYCL: Use coarse-grained event in clearDeviceBufferAsync
Andrey Alekseenko
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over 1 year ago
Fix XTC support for gigantic systems (300M atoms)
Erik Lindahl
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over 1 year ago
COPYING: Remove TABs and ^L characters
Andrey Alekseenko
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over 1 year ago
Fix for crash when CUDA Graphs are enabled on multi-GPU
Alan Gray
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over 1 year ago
gmx dssp: Improve accuracy and add option to clear defective residues
Sergey Gorelov
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over 1 year ago
Merge remote-tracking branch 'gromacs/release-2023'
M. Eric Irrgang
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over 1 year ago
Add NVSHMEM CMake support and a basic test with CI support
Mahesh Doijade
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over 1 year ago
Merge release-2023 into main
Andrey Alekseenko
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over 1 year ago
Merge branch release-2023 into main
Andrey Alekseenko
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over 1 year ago
Added check for excluded pairs beyond cut-off with FE and RF
Berk Hess
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over 1 year ago
Fix a formatted string logic error.
M. Eric Irrgang
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over 1 year ago
Fix overflow in getDDGridSetup()
Berk Hess
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over 1 year ago
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