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Improve documentation links
2019-03-01
Roland Schulz
Improve documentation links
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2019-02-20
Berk Hess
Add havePPDomainDecomposition()
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2019-02-19
Roland Schulz
Add GMX_OCL_SHOW_DIAGNOSTICS env option
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2019-02-02
Roland Schulz
Fix Intel compiler on Windows build
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2019-02-02
Roland Schulz
Add recommendation of how to compile with MPI
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2019-01-31
Roland Schulz
Fix clfft build
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2019-01-30
Roland Schulz
Change all C to C++ outside of TNG
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2019-01-23
Paul Bauer
Fix bug introduced in 9c2eb03b
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2019-01-23
Roland Schulz
Merge release-2018 into release-2019
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2019-01-18
Mark Abraham
Disabled internal clFFT when using MSVC with OpenCL
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2018-10-02
Roland Schulz
Narrow scope of ICC compiler work-around
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2018-09-16
Berk Hess
Refactoring in DD redistribute
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2018-09-15
Roland Schulz
Replace slave with agent
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2018-09-14
Roland Schulz
Warn for type mismatch for gmx printf like functions 3/3
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2018-09-12
Roland Schulz
Warn for type mismatch for gmx printf like functions 2/3
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2018-09-12
Roland Schulz
Add SSE2 + double config
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2018-09-11
Roland Schulz
Fix SSE4.1 after change to C++
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2018-09-06
Roland Schulz
Change CanBePinned to PinnedIfSupported
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2018-09-05
Roland Schulz
Remove meta information from host allocator policy
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2018-09-02
Roland Schulz
Turn DlbState into scoped enum
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2018-08-29
Roland Schulz
Document clang-tidy libstdc++ incompatibility
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2018-08-26
Alexey Shvetsov
Add basic operations for gmx::BasicVector<>
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2018-08-18
Roland Schulz
readability-implicit-bool-conversion 1/2
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2018-08-18
Roland Schulz
clang-tidy modernize
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2018-08-18
Roland Schulz
clang-tidy: google tests applicable
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2018-08-13
Roland Schulz
Remove code duplication in trajana/modules/trajectory
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2018-08-13
Roland Schulz
Remove cppcheck
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2018-08-13
Roland Schulz
Fix MSD
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2018-08-12
Roland Schulz
3/3 of old-style casting
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2018-08-11
Roland Schulz
Enable clang-tidy for headers
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2018-08-10
Roland Schulz
Avoid using global variables in programs
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2018-08-08
Roland Schulz
Fix part of old-style casting
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2018-08-08
Roland Schulz
Remove gmx custom fixed int (e.g. gmx_int64_t) types
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2018-07-14
Roland Schulz
MSVC: enable code analysis
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2018-07-12
Roland Schulz
Fix clang-tidy cmake messages
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2018-07-12
Roland Schulz
Temporary disable armhpc-18.2
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2018-07-12
Roland Schulz
Require ICC 17.0.1
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2018-07-12
Mark Abraham
Bump minimum MSVC version to 2017
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2018-07-10
Mark Abraham
Add infrastructure for tools cleanup
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2018-07-10
Roland Schulz
Clang warnings: unreachable
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2018-07-06
Mark Abraham
Use fewer gcc-4.8 configurations
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2018-07-05
Roland Schulz
Fix compiler warnings in OCL
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2018-07-04
Roland Schulz
Merge release-2018 into master
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2018-07-04
Roland Schulz
Enable more warnings for Clang 6
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2018-07-03
Roland Schulz
Fix post-submit issues
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2018-07-03
Mark Abraham
Fix clang CUDA build
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2018-07-03
Roland Schulz
clang-tidy: more misc+readability
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2018-06-28
Roland Schulz
clang-tidy: performance-type-promotion-in-math-fn
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2018-06-28
Roland Schulz
Clang-tidy: enable further tests
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2018-06-23
Roland Schulz
clang-tidy: Enable most bugprone checks
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2018-06-23
Roland Schulz
Allow to enable clang-tidy with GMX_CLANG_TIDY
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2018-05-21
Roland Schulz
Fix illegal instruction error on KNL
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2018-05-15
Roland Schulz
Allow OCL CL_SIZE to be set to 4 for Intel
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2018-02-08
Mark Abraham
Use more portable python shebangs
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2018-01-22
Roland Schulz
AVX512: copysign
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2018-01-19
Roland Schulz
AVX512 GCC 5.3 work-around
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2018-01-18
Roland Schulz
Remove incorrect release-note entry
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2018-01-18
Roland Schulz
Avoid dynamic STL containers in global init
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2018-01-05
Roland Schulz
Remove unused defines
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2017-12-26
Roland Schulz
Fix quote
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2017-12-17
Roland Schulz
Merge branch release-2018
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2017-12-17
Roland Schulz
Fix typo introduced in b1b1163a245
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2017-12-13
Roland Schulz
Remove int support for SimdArrayRef
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2017-12-12
Roland Schulz
Add work-around for ICC 18.0/.1
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2017-12-12
Erik Lindahl
Require TPR file for gmx cluster
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2017-12-12
Roland Schulz
Fix shift usage for KNC
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2017-12-08
Mark Abraham
Refine ulp tolerances for some more ewald tests
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2017-12-08
Berk Hess
Correct Shake test tolerances
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2017-12-06
Roland Schulz
Fix ICC warnings
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2017-12-06
Roland Schulz
Added doxygen note to clarify rounding mode of SIMD
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2017-11-27
Roland Schulz
Fix bugs introduced in c4cd996
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2017-11-10
Roland Schulz
PME-gather: 4xN SIMD
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2017-10-11
Roland Schulz
Require template parameter for load function
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2017-10-11
Roland Schulz
Use tag for simdLoad
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2017-10-05
Roland Schulz
Make ConstArrayRef alias to ArrayRef<const T>
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2017-09-02
M. Eric Irrgang
Remove macro that confuses some debuggers
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2017-09-02
Berk Hess
Put all domdec options in a struct
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2017-08-29
Aleksei Iupinov
Remove leftover function declaration
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2017-08-29
Roland Schulz
Enable missing declarations warning
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2017-08-28
Roland Schulz
Enable unused function warning
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2017-08-28
Erik Lindahl
Improved SIMD test data to use all bits
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2017-06-28
Roland Schulz
Merge "Merge branch release-2016"
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2017-06-28
Roland Schulz
Fix ICC workaround for C++11 feature check
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2017-06-27
Roland Schulz
Merge branch release-2016
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2017-05-11
Roland Schulz
Remove static-intel from default flags
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2017-05-01
David van der Spoel
Xpm test for gmx clustsize
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2017-04-17
Erik Lindahl
Fixed AVX-512F compiler flags
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2017-04-10
Vedran Miletić
Really enable avx512 in fftw only for select compilers
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2017-02-25
Michael Shirts
Fix for an incorrect check that nstlog !=0
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2017-02-23
Roland Schulz
Fix compile of GMX_SIMD=None with ICC
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2017-01-13
Roland Schulz
Enable uncrustify for template
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2017-01-10
Roland Schulz
Fix AVX512 issues in debug mode
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2017-01-05
Roland Schulz
Supress ICC 16 on Windows false postives
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2017-01-05
Roland Schulz
Fix copyright year of previous commit
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2016-12-20
Mark Abraham
Improve build system for plugin support
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2016-12-15
M. Eric Irrgang
Fix syntax in cmake status message
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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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2016-12-15
Vedran Miletić
Improve include sorter error reporting
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2016-12-15
Mark Abraham
Removed support for multiple entries in mdp files
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