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Tidy: modernize-use-nullptr
2017-01-11
Roland Schulz
Tidy: modernize-use-nullptr
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2017-01-10
Roland Schulz
Fix AVX512 issues in debug mode
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2017-01-05
Roland Schulz
Fix copyright year of previous commit
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2017-01-05
Roland Schulz
Fix unitialized memory access
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2016-12-15
Roland Schulz
Add create_unique_with_deleter
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2016-12-15
Roland Schulz
Replace scoped_cptr with unique_cptr
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2016-11-03
Roland Schulz
Supress ICC 16 on Windows false postives
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2016-10-30
Roland Schulz
Replace qsort/bsearch with std::sort/lower_bound
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2016-10-21
Roland Schulz
Suppress cppcheck warning
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2016-09-18
Roland Schulz
Fix math-test false positive
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2016-09-18
Roland Schulz
Better optimized ICC release flags
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2016-09-13
Roland Schulz
Tidy: modernize-use-emplace
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2016-08-27
Roland Schulz
Fix build with GMX_USE_TNG=off
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2016-08-24
Roland Schulz
Remove unnecessary ICC warning suppression
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2016-07-30
Roland Schulz
Update GCC version for reference build
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2016-07-23
Roland Schulz
Merge release-2016 into master
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2016-07-18
Roland Schulz
Fix non-parallel build
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2016-06-02
Roland Schulz
Fix ICC 16u3 build
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2016-05-28
Roland Schulz
Fix build with clang 3.1+3.2
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2016-05-17
Roland Schulz
Add reference to TopoTools 1.6
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2016-05-13
Roland Schulz
Don't use abort for fatal errors
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2016-05-10
Roland Schulz
Add OpenMP for functions limiting scaling
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2016-04-28
Roland Schulz
Merge "Merge branch release-5-1"
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2016-04-26
Roland Schulz
Fix numerically unstable Gaussian test
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2016-04-19
Roland Schulz
Fix numerically unstable selection test
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2016-04-19
Roland Schulz
Tune nstlist increase for KNL
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2016-04-15
Roland Schulz
Fix AVX512 suggestion
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2016-04-15
Roland Schulz
Remove idioms deprecated in C++11
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2016-04-06
Roland Schulz
AVX512 transposeScatterIncr/DecrU with load/store
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2016-04-02
Roland Schulz
Fix coolquotes
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2016-03-11
Roland Schulz
Fix MPI_IN_PLACE test
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2016-03-10
Roland Schulz
Improve AVX512
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2015-12-27
Roland Schulz
Fix G++ 4.7.0
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2015-12-08
Roland Schulz
Remove old MSVC references
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2015-09-30
Roland Schulz
Require C++11
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2015-09-30
Roland Schulz
Manually propagate CUDA host compiler flags
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2015-09-27
Roland Schulz
Converted 4xn kernel to C++
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2015-09-23
Roland Schulz
Bump required CUDA version from 4.0+ to 5.0+
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2015-08-15
Roland Schulz
Fix Clang warning
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2015-08-07
Roland Schulz
Fix VS2015 warning
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2015-08-07
Roland Schulz
Fix missing include
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2015-08-06
Roland Schulz
Replace AI, AJ, .. and C0, C1, C2 macros with functions
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2015-07-28
Roland Schulz
Converted 2xnn kernel to C++
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2015-07-11
Roland Schulz
Update kernel templates to match kernels
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2015-07-09
Roland Schulz
New quotes
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2015-07-08
Roland Schulz
Merge release-5-1 into master
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2015-07-08
Roland Schulz
Merge release-5-0 into release-5-1
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2015-07-08
Roland Schulz
Merge release-4-6 into release-5-0
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2015-06-28
Roland Schulz
Remove unused cmake files
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2015-06-28
Roland Schulz
Don't use check_library for libm
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2015-06-25
Roland Schulz
Fix Wundef warnings
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2015-06-22
Roland Schulz
Fix GMX_ALIGNMENT for MSVC 2012 and 2013
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2015-06-22
Roland Schulz
Fix cmake 3.1 warnings with MSVC
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2015-06-19
Roland Schulz
Fix missing include
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2015-06-16
Roland Schulz
Fix warning in uncrustify
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2015-06-16
Roland Schulz
Fix consts in bonded and clincs
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2015-06-06
Roland Schulz
Use stat to check that paths are equivalent
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2015-06-05
Roland Schulz
Merge release-5-0 into master
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2015-06-05
Roland Schulz
Reenable lincs/bonded SIMD for ICC on Windows
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2015-06-03
Roland Schulz
Use stack buffer for LINCS&bonded gather/scatter
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2015-05-30
Roland Schulz
Work-around for ICC 15 on Phi
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2015-05-26
Roland Schulz
Don't set CFLAGS for Phi in toolchain
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2015-05-13
Roland Schulz
Facilitate linking of static binaries
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2015-03-17
Roland Schulz
Fix linking with static libxml2
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2015-03-04
Roland Schulz
Fix GCC5 warnings
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2015-03-03
Roland Schulz
nbnxn utils performance improvement for Phi
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2015-03-02
Roland Schulz
Don't search installation prefix if binary is not found
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2015-02-25
Roland Schulz
C++ conversion for PME spread/gather
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2015-02-12
Roland Schulz
Merge release-5-0 into master
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2015-02-12
Roland Schulz
Merge release-4-6 into release-5-0
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2015-02-10
Roland Schulz
Don't set CFLAGS for Phi in toolchain
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2015-02-10
Roland Schulz
Work-around for ICC 15 on Phi
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2015-02-07
Roland Schulz
Make FindBoost quite
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2015-02-02
Roland Schulz
Fix FP exception in FE
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2015-01-27
Roland Schulz
Workaround for MemorySanitizer
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2015-01-27
Roland Schulz
Fix unitlized memory read in checkpoint
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2015-01-05
Roland Schulz
Enable fp-exceptions
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2014-12-18
Roland Schulz
Fix CMP0054 cmake 3.1.0 warnings
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2014-12-17
Roland Schulz
Merge "Merge branch 'release-5-0'"
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2014-12-17
Roland Schulz
Fix cppcheck-1.67 warnings
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2014-12-15
Roland Schulz
Fix NVML detection on Windows
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2014-12-13
Roland Schulz
Use bitmask for bonded
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2014-12-07
Roland Schulz
Merge release-5-0 into master
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2014-11-26
Roland Schulz
Fix clang with boost 1.46.1 and 1.47
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2014-11-26
Roland Schulz
Merge release-5-0 into master
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2014-11-23
Roland Schulz
Set GMX_SIMD to MIC for Xeon Phi
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2014-11-12
Roland Schulz
Use stat to check that paths are equivalent
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2014-11-12
Roland Schulz
Add bitmask type
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2014-11-09
Roland Schulz
Backport valgrind suppression
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2014-11-09
Roland Schulz
Fix CMP0054 cmake 3.1.0 warnings
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2014-11-05
Roland Schulz
Minor update of boost README
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2014-10-30
Roland Schulz
Merge "Merge release-5-0 into master"
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2014-10-26
Roland Schulz
Add Windows support for host-/username
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2014-10-22
Roland Schulz
Remove Catamount cmake
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2014-10-21
Roland Schulz
Fix C++11 flags for MingW
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2014-10-20
Roland Schulz
Create scoped_cptr to replace scoped_ptr_sfree
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2014-10-20
Roland Schulz
Used IWYU to partially clean up some includes
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2014-10-12
Roland Schulz
Fix misidentification of dot in path name
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2014-10-05
Roland Schulz
Allow runAsMainSingleModule to be called more than...
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2014-09-29
Roland Schulz
Clarify GCC+Win+AVX warning
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