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Add SIMD for AWH
2017-11-19 Berk HessAdd SIMD for AWH
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2017-11-18 Magnus LundborgAdded Magnus Lundborg as contributor in the manual.
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2017-11-18 Aleksei IupinovAsynchronous CUDA transfers are asserted to always...
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2017-11-10 Roland SchulzRevert "Use -mavx2 -mfma instead of -march with AVX2"
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2017-11-08 Roland SchulzFix scalar blend
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2017-11-08 Magnus LundborgUpdate to TNG v 1.8.1
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2017-09-09 Berk HessAvoid inf in SIMD double sqrt()
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2017-07-19 Mark AbrahamImprove CMake implementation for GMX_SIMD
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2017-06-29 Teemu MurtolaGeneralize IForceProvider
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2017-06-15 Szilárd PállAllow disabling the explicit use of CUDA textures
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2017-06-14 Mark AbrahamSimplify reporting from init_gpu
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2017-06-13 Erik LindahlMore quotes
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2017-06-07 Vedran MiletićDocument floating-point arithmetic
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2017-05-29 Szilárd PállQuotes are cool, typo-free ones are even "cooler"
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2017-05-27 Mark AbrahamQuotes from Gottingen workshop
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2017-05-14 Berk HessFix bugs in double Simd4 implementations
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2017-03-19 Erik LindahlUse OpenMP up to 16 threads with AMD Ryzen
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2017-03-19 Erik Lindahl128-bit AVX2 SIMD for AMD Ryzen
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2017-03-19 Mark AbrahamFix string handling for gcc 7
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2017-03-14 Erik LindahlFix gcc compiles of AVX-512 SIMD
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2017-02-14 Mark AbrahamFix handling of previous virials
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2017-02-10 Roland SchulzRemove duplicate AVX512 gather definitions
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2017-02-09 Mark AbrahamRemove EST_DISTR from state.h
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2017-02-09 Mark AbrahamEnhance warninp
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2017-02-08 Roland SchulzAVX512: Use double-sized gather for pairs of floats
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2017-02-07 Mark AbrahamIntroduced system preparation section to user guide
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2017-02-03 David van der SpoelFixes SEGV in gmx order.
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2017-01-11 Roland SchulzTidy: modernize-use-nullptr
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2016-11-03 Roland SchulzSupress ICC 16 on Windows false postives
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2016-10-30 Teemu MurtolaSupport normalizing values in KeyValueTree
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2016-10-30 Roland SchulzReplace qsort/bsearch with std::sort/lower_bound
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2016-10-11 Mark AbrahamUpdate for FFTW 3.3.5
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2016-09-26 David van der SpoelFixes issue with Release build in correlation functions.
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2016-09-18 Roland SchulzFix math-test false positive
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2016-09-18 Roland SchulzBetter optimized ICC release flags
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2016-09-12 Mark AbrahamPreliminary clean up of NVML code
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2016-09-12 Berk HessAdd const to thread-MPI functions
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2016-09-12 Vedran MiletićDocument wallcycle counters and subcounters
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2016-09-12 Teemu MurtolaFix various memory leaks
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2016-07-31 James GrahamAvoid blank line in writing index file
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2016-07-30 Roland SchulzUpdate GCC version for reference build
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2016-07-30 Vedran MiletićDocument gmx_cgsort_t and gmx_domdec_sort_t structs
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2016-07-08 Erik LindahlUpdate affinity checking for Intel compiler
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2016-07-08 Szilárd PállAdd PDF metadata to the manual
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2016-07-07 Erik LindahlReduce hwloc & cpuid test requirements
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2016-07-07 Teemu MurtolaChange handling for missing releng docs
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2016-07-07 Szilárd PállAdd user guide info on CUDA application clocks
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2016-07-07 Mark AbrahamFix build if libcuda is found but nvcc is not
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2016-06-07 Semen YesylevskyyAdded manual section about embedding proteins to membranes.
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2016-06-05 Szilárd PállAdd support for CUDA CC 6.0/6.1
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2016-06-03 Berk HessHandle partially frozen and constrained atoms
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2016-06-02 Szilárd PállAdd env. var. to enable OpenCL caching
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2016-06-02 Szilárd PállFix OpenCL binary cache file name generation
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2016-06-02 Roland SchulzFix ICC 16u3 build
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2016-06-02 Patrick WelcheEnsure IMD include dependencies work
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2016-05-29 Mark AbrahamSimplified and updated OpenCL compilation
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2016-05-08 Berk HessUpdate mdrun termination info
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2016-04-03 Berk HessCorrect nrdf for 1D/2D systems
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2015-09-30 Roland SchulzRequire C++11
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2015-08-13 Mark AbrahamRe-enable multi-GPU support in OpenCL for thread MPI
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2015-07-05 Berk HessFix DD DLB state issue
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The ultimate molecular dynamics simulation package