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2020-01-01	Erik Lindahl	Add link to paper explaining GROMOS twin-range issues.	commit \| commitdiff \| tree
2019-12-29	Erik Lindahl	Write TPR body as opaque XDR data in big-endian format	commit \| commitdiff \| tree
2019-11-13	Erik Lindahl	Updated physical constants to CODATA 2018	commit \| commitdiff \| tree
2019-11-06	Erik Lindahl	Work around broken Apple compilers in Mac OS 10.15	commit \| commitdiff \| tree
2019-11-06	Erik Lindahl	Work around broken Apple compilers in Mac OS 10.15	commit \| commitdiff \| tree
2019-09-13	Erik Lindahl	Add rounding correction to unsafe simd exp tests too	commit \| commitdiff \| tree
2019-09-13	Erik Lindahl	Fix clang tidy warnings in SIMD code	commit \| commitdiff \| tree
2019-09-12	Erik Lindahl	Adjust test range and fix singleaccuracy tests	commit \| commitdiff \| tree
2019-09-12	Erik Lindahl	Added SIMD cbrt and invcbrt functions	commit \| commitdiff \| tree
2019-09-12	Erik Lindahl	Added SIMD log2 and pow math functions	commit \| commitdiff \| tree
2019-09-12	Erik Lindahl	Update SIMD math tests and improve accuracy	commit \| commitdiff \| tree
2019-09-03	Erik Lindahl	Fix CPU detection and SIMD on modern Mac/cmake combos	commit \| commitdiff \| tree
2019-08-30	Erik Lindahl	Fix CPU detection and SIMD on modern Mac/cmake combos	commit \| commitdiff \| tree
2019-08-29	Erik Lindahl	Some quotes I bumped into last week	commit \| commitdiff \| tree
2019-08-23	Erik Lindahl	Default to AVX2_256 SIMD for Zen2	commit \| commitdiff \| tree
2019-08-20	Erik Lindahl	Avoid using GMX_SIMD macros to detect _mm_pause()	commit \| commitdiff \| tree
2019-06-09	Erik Lindahl	More quotes	commit \| commitdiff \| tree
2019-05-16	Erik Lindahl	Added more quotes	commit \| commitdiff \| tree
2018-08-14	Erik Lindahl	Fix SIMD anyTrue bug, and add better unit test	commit \| commitdiff \| tree
2018-06-06	Erik Lindahl	Use default CMake path variables	commit \| commitdiff \| tree
2018-06-06	Erik Lindahl	Bump GMX_BUILD_OWN_FFTW to 3.3.8 to avoid bugs	commit \| commitdiff \| tree
2018-01-10	Erik Lindahl	Improve pdb2gmx for nonstandard residue types	commit \| commitdiff \| tree
2018-01-10	Erik Lindahl	Clarified gmx rmsf documentation	commit \| commitdiff \| tree
2018-01-05	Erik Lindahl	Test that nvcc/host compiler combo works	commit \| commitdiff \| tree
2018-01-05	Erik Lindahl	Make TNG writing work with multiple identical steps	commit \| commitdiff \| tree
2018-01-05	Erik Lindahl	Add AVX_512 and KNC symbols to FFTW SIMD test	commit \| commitdiff \| tree
2018-01-04	Erik Lindahl	Improve frame time/step handling in trjconv	commit \| commitdiff \| tree
2018-01-04	Erik Lindahl	Implement changes for CMake policy 0068	commit \| commitdiff \| tree
2018-01-03	Erik Lindahl	Fix trjconv for tdump<frame timestep	commit \| commitdiff \| tree
2018-01-03	Erik Lindahl	Fix index error in gmx chi	commit \| commitdiff \| tree
2018-01-03	Erik Lindahl	Fix complexity for large exclusion orders	commit \| commitdiff \| tree
2018-01-03	Erik Lindahl	Don't allow multiple energy groups for GPU runs	commit \| commitdiff \| tree
2018-01-03	Erik Lindahl	Remove duplications in GMXLIB search paths	commit \| commitdiff \| tree
2018-01-03	Erik Lindahl	Avoid FTZ triggering simd test failures	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Document required position restraint files	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Allow empty lines in hdb files	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Fix OpenCL compiles on Mac OS	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Improve manual from comments by Gang Liu	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Make it explicit that time units apply to begin/end...	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Don't require matching names between rtp and tdb files	commit \| commitdiff \| tree
2018-01-02	Erik Lindahl	Don't write reference pull group 0 to log	commit \| commitdiff \| tree
2018-01-01	Erik Lindahl	Fix gmx density for non-mass calculations	commit \| commitdiff \| tree
2018-01-01	Erik Lindahl	Clarify XTC error message	commit \| commitdiff \| tree
2017-12-26	Erik Lindahl	Fix builds on ARM & clarify (ARM) GPU support	commit \| commitdiff \| tree
2017-12-19	Erik Lindahl	Use reduced default tolerances for tpx comparison	commit \| commitdiff \| tree
2017-12-14	Erik Lindahl	Work around AVX-512 issues in gcc-5.4 and 7.1	commit \| commitdiff \| tree
2017-12-14	Erik Lindahl	Fix PBC error in gmx_spatial	commit \| commitdiff \| tree
2017-12-12	Erik Lindahl	Documented power spectrum to gmx velacc	commit \| commitdiff \| tree
2017-12-12	Erik Lindahl	Require TPR file for gmx cluster	commit \| commitdiff \| tree
2017-12-12	Erik Lindahl	Disallow ascii formats for gmx trjcat	commit \| commitdiff \| tree
2017-12-11	Erik Lindahl	Remove duplicated lines from OPLS ffbonded.itp	commit \| commitdiff \| tree
2017-12-11	Erik Lindahl	Don't warn about NVML clocks that are at max	commit \| commitdiff \| tree
2017-12-10	Erik Lindahl	Revert "Disable default-on NVML support in CMake"	commit \| commitdiff \| tree
2017-12-07	Erik Lindahl	Added cool quote from Viveca's defense	commit \| commitdiff \| tree
2017-12-04	Erik Lindahl	Fix compilation issues for AVX-512	commit \| commitdiff \| tree
2017-11-28	Erik Lindahl	Fix AVX-512 SIMD test for C	commit \| commitdiff \| tree
2017-11-28	Erik Lindahl	Improve status messages for SIMD checks	commit \| commitdiff \| tree
2017-11-27	Erik Lindahl	Test more AVX-512F instructions before enabling support	commit \| commitdiff \| tree
2017-11-24	Erik Lindahl	Detect AVX-512 FMA units to choose best SIMD	commit \| commitdiff \| tree
2017-11-21	Erik Lindahl	Separate SIMD flag detection from management	commit \| commitdiff \| tree
2017-11-12	Erik Lindahl	Only issue FFT warning messages on changes	commit \| commitdiff \| tree
2017-09-12	Erik Lindahl	Improve accuracy of SIMD exp for small args	commit \| commitdiff \| tree
2017-09-04	Erik Lindahl	More SIMD math argument checking, added unsafe options	commit \| commitdiff \| tree
2017-08-28	Erik Lindahl	Improved SIMD test data to use all bits	commit \| commitdiff \| tree
2017-06-26	Erik Lindahl	Fix ARM NEON simd debug builds	commit \| commitdiff \| tree
2017-06-13	Erik Lindahl	More quotes	commit \| commitdiff \| tree
2017-05-23	Erik Lindahl	Updated cool quotes	commit \| commitdiff \| tree
2017-04-17	Erik Lindahl	Fixed AVX-512F compiler flags	commit \| commitdiff \| tree
2017-03-19	Erik Lindahl	Use OpenMP up to 16 threads with AMD Ryzen	commit \| commitdiff \| tree
2017-03-19	Erik Lindahl	128-bit AVX2 SIMD for AMD Ryzen	commit \| commitdiff \| tree
2017-03-14	Erik Lindahl	Fix gcc compiles of AVX-512 SIMD	commit \| commitdiff \| tree
2017-02-09	Erik Lindahl	Work around false xlc-13.1.5 bug in SIMD test	commit \| commitdiff \| tree
2016-10-17	Erik Lindahl	New classes for spline interpolation tables	commit \| commitdiff \| tree
2016-09-07	Erik Lindahl	Bump oldest cmake, compiler and CUDA versions required	commit \| commitdiff \| tree
2016-08-05	Erik Lindahl	Fix proper relative tolerance checking in testutils	commit \| commitdiff \| tree
2016-07-11	Erik Lindahl	Fix membed with partial revert of 29943f	commit \| commitdiff \| tree
2016-07-09	Erik Lindahl	Hardware detection clean-up and pre/post-processing	commit \| commitdiff \| tree
2016-07-09	Erik Lindahl	Prevent fragile use cases of checkpoint appending	commit \| commitdiff \| tree
2016-07-08	Erik Lindahl	Update affinity checking for Intel compiler	commit \| commitdiff \| tree
2016-07-08	Erik Lindahl	Add detection for ARMv7 cycle counter support	commit \| commitdiff \| tree
2016-07-08	Erik Lindahl	Work around compiler issue with random test	commit \| commitdiff \| tree
2016-07-07	Erik Lindahl	Reduce hwloc & cpuid test requirements	commit \| commitdiff \| tree
2016-06-08	Erik Lindahl	Disable static libcudart on OS X	commit \| commitdiff \| tree
2016-06-04	Erik Lindahl	Check number of items read in mdp statements	commit \| commitdiff \| tree
2016-05-27	Erik Lindahl	Detect the usage of hwtop XML caching	commit \| commitdiff \| tree
2016-05-21	Erik Lindahl	Disable automated FFTW3 builds on Windows	commit \| commitdiff \| tree
2016-05-10	Erik Lindahl	Fixed large file issue on 32-bit platforms	commit \| commitdiff \| tree
2016-05-10	Erik Lindahl	Fix precision loss in tabulated normal distribution	commit \| commitdiff \| tree
2016-05-10	Erik Lindahl	Flush streams when not writing newline character	commit \| commitdiff \| tree
2016-05-09	Erik Lindahl	Improved description for GPU/CPU time ratio	commit \| commitdiff \| tree
2016-05-08	Erik Lindahl	Fix Luzar/Chander literature reference in g_hbond	commit \| commitdiff \| tree
2016-05-05	Erik Lindahl	Fix SIMD detection on AMD AVX CPUs w/o fma (master)	commit \| commitdiff \| tree
2016-05-05	Erik Lindahl	Avoid allocating heap memory for tabulated distribution	commit \| commitdiff \| tree
2016-04-04	Erik Lindahl	Fix hwloc narrowing warning on 32-bit architectures	commit \| commitdiff \| tree
2016-04-04	Erik Lindahl	Fix compile error for IBM VMX on ppc64	commit \| commitdiff \| tree
2016-04-04	Erik Lindahl	Fix SIMD detection on new AMD AVX CPUs w/o fma	commit \| commitdiff \| tree
2016-04-03	Erik Lindahl	Fix unit test segfaults with gcc-6.0	commit \| commitdiff \| tree
2016-04-03	Erik Lindahl	Fix incorrect return type for scalar version of simd...	commit \| commitdiff \| tree
2016-03-09	Erik Lindahl	Random engines & distributions as proper C++11 classes	commit \| commitdiff \| tree
2016-03-09	Erik Lindahl	Support for portable hardware locality (hwloc)	commit \| commitdiff \| tree
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