alexxy/gromacs.git
2013-01-03 Justin LemkulFixed format error in online manual.
2013-01-03 Christoph JunghansMerge "Remove non-functional PowerPC invsqrt." into...
2012-12-30 Erik LindahlMerge "Thread-MPI fixes for i386 llvm & simplification...
2012-12-30 Teemu MurtolaRemove non-functional PowerPC invsqrt.
2012-12-30 Christoph Junghanscmake: add option to install libmd as libgmxmd
2012-12-29 Sander PronkThread-MPI fixes for i386 llvm & simplification of...
2012-12-22 Mark AbrahamNew beta release: 4.6-beta3
2012-12-22 Christoph Junghanscmake: mark FFTW_HAVE_{SIMD,AVX} as advanced
2012-12-22 Roland SchulzAdd missing visibility exports
2012-12-21 Christoph JunghansMerge "Remove non-functional compiler override for...
2012-12-21 Erik LindahlFixed gmx_cpuid not working on non-x86
2012-12-21 Teemu MurtolaRemove non-functional compiler override for MacOSX.
2012-12-20 Szilard Pallfix incorrect gmx_fatal argument order
2012-12-20 Erik LindahlMerge "cmake: added option to disable quotes" into...
2012-12-20 Erik LindahlMerge "Small fix for g_tune_pme" into release-4-6
2012-12-20 Erik LindahlMerge "Fixes for andersen temperature control" into...
2012-12-20 Erik LindahlMerge "Fixes for expanded ensemble and HREPEX" into...
2012-12-20 Christoph JunghansMerge "Fixed AVX256 double-precision kernels for gcc...
2012-12-20 Christoph Junghanscmake: added option to disable quotes
2012-12-20 Michael ShirtsFixes for andersen temperature control
2012-12-20 Michael ShirtsFixes for expanded ensemble and HREPEX
2012-12-20 Erik LindahlFixed AVX256 double-precision kernels for gcc
2012-12-20 Michael ShirtsFix for the pressure in MTTK with constraints + dispersion
2012-12-20 Carsten KutznerSmall fix for g_tune_pme
2012-12-20 Berk Hessfixed recent bugs in LINCS for derivatives
2012-12-19 Mark AbrahamMerge "Remove the rest of the fortran/power6 accelerati...
2012-12-19 Mark AbrahamMerge "Always build template program" into release-4-6
2012-12-19 Mark AbrahamFix Reference build type
2012-12-19 Szilárd PállMerge "Avoid using undefined CMake variables" into...
2012-12-19 Szilárd PállMerge "Removed orphan file" into release-4-6
2012-12-19 Roland SchulzMerge "Fix license text printed by programs." into...
2012-12-19 Roland SchulzMerge changes Idc652236,If03cf569 into release-4-6
2012-12-19 Roland SchulzMerge "issue error if GPU ID is provided with GPU acc...
2012-12-19 Mark AbrahamRemoved orphan file
2012-12-19 Mark AbrahamAvoid using undefined CMake variables
2012-12-18 Christoph JunghansMerge "Fixes redmine issue #1071" into release-4-6
2012-12-18 Szilard Pallissue error if GPU ID is provided with GPU acc. off
2012-12-18 Berk Hessrenamed gmx_x86_simd_macros.h to gmx_simd_macros.h
2012-12-18 Berk Hessimplemented nbnxn AVX-256 2x(N+N) kernels
2012-12-17 Szilárd PállMerge "reduced PLINCS communication with H-bond constra...
2012-12-17 Teemu MurtolaFix license text printed by programs.
2012-12-17 Christoph JunghansRemove the rest of the fortran/power6 acceleration
2012-12-14 Michael ShirtsFixes redmine issue #1071
2012-12-13 Mark AbrahamFix typo
2012-12-13 Christoph JunghansAlways build template program
2012-12-11 Christoph JunghansMerge "Fix compilation with PGI" into release-4-6
2012-12-11 Berk Hessreduced PLINCS communication with H-bond constraints
2012-12-10 Christoph JunghansMerge "force C++ linking of the gpu_utils" into release-4-6
2012-12-09 Roland SchulzMerge "fixed GPU pair-search with GMX_CPU_ACCELERATION...
2012-12-09 Roland SchulzMerge "Fix build of template and other external code...
2012-12-08 Roland SchulzFix compilation with PGI
2012-12-07 Berk Hessfixed GPU pair-search with GMX_CPU_ACCELERATION=None
2012-12-06 Roland SchulzMake SSE4.1 warning clearer
2012-12-06 Mark AbrahamNew beta release: 4.6-beta2
2012-12-06 Mark AbrahamApply LGPL license to new files
2012-12-06 Mark AbrahamUpdates for install guide
2012-12-06 Michael ShirtsRemoving (inaccurate) virial temperature calc.
2012-12-06 Teemu MurtolaFix build of template and other external code.
2012-12-06 Sebastian FritschRe-enable AdResS feature
2012-12-06 Berk Hessremoved last OpenMP O(nthreads) bottleneck
2012-12-06 Mark AbrahamEliminate confusion from pkgconfig FFTW detection
2012-12-05 Szilard Palldon't warn during configuring if no GPUs were found
2012-12-05 Christoph Junghansfixed obsolete gmx_fatal in OpenMM build
2012-12-05 Szilard Pallfirst step toward moving OpenMM support to contrib
2012-12-05 Mark AbrahamMerge "don't auto-set nvcc host compiler with cmake...
2012-12-05 Mark AbrahamMerge "Keep FindCUDA quiet when it is not useful" into...
2012-12-05 Mark AbrahamMerge "Remove TEST_TMPI_ATOMICS_ONLY" into release-4-6
2012-12-05 Mark AbrahamMerge "Re-apply -dev version name between beta 1 and...
2012-12-05 Roland SchulzMerge "fixed segv in Verlet pair-search with trilinic...
2012-12-05 Mark AbrahamMerge "Fixed labelling of g_hbond plots" into release-4-6
2012-12-05 Roland SchulzMerge "fixed incorrect virial with virtual sites and...
2012-12-05 Roland SchulzRemove TEST_TMPI_ATOMICS_ONLY
2012-12-05 Mark AbrahamRe-apply -dev version name between beta 1 and beta 2
2012-12-05 Berk Hessfixed incorrect virial with virtual sites and OpenMP
2012-12-05 Mark AbrahamKeep FindCUDA quiet when it is not useful
2012-12-05 Berk Hessfixed segv in Verlet pair-search with trilinic DD
2012-12-05 Erik MarklundFixed labelling of g_hbond plots
2012-12-05 Szilard Palldon't auto-set nvcc host compiler with cmake >2.8.9
2012-11-30 Szilard Pallforce C++ linking of the gpu_utils
2012-11-30 Berk Hessfixed issue with -multi and GPUs
2012-11-29 Mark AbrahamUpdate copyright statements and change license to LGPL
2012-11-29 Szilard Pallmade errors during GPU detection non-fatal
2012-11-29 Szilard Pallfix cmake re-running failure introduced by ef1127f
2012-11-29 Mark AbrahamMerge "Initial commit of new install guide" into releas...
2012-11-29 Mark AbrahamMerge "Bump version to 4.6-beta1" into release-4-6
2012-11-29 Mark AbrahamInitial commit of new install guide
2012-11-29 Mark AbrahamBump version to 4.6-beta1
2012-11-29 Mark AbrahamMerge "Added .gitignore for kernel generation" into...
2012-11-29 Mark AbrahamMerge "Double precision AVX-256 kernels" into release-4-6
2012-11-29 Mark AbrahamAdded .gitignore for kernel generation
2012-11-29 Mark AbrahamMerge "Fixing issue with GPU detection reporting" into...
2012-11-29 Mark AbrahamMerge "Double precision AVX_128_FMA kernels" into relea...
2012-11-29 Mark AbrahamMerge "Fix: pthread variables were overwritten by gmxMa...
2012-11-29 Erik LindahlDouble precision AVX-256 kernels
2012-11-29 Erik LindahlDouble precision AVX_128_FMA kernels
2012-11-29 Mark AbrahamFixing issue with GPU detection reporting
2012-11-29 Christoph JunghansMerge "Print error if no thread support is available...
2012-11-29 Mark AbrahamRefuse to build with clang 3.0
2012-11-29 Mark AbrahamAdd a CMake warning about FFTW with --enable-avx
2012-11-29 Mark AbrahamMerge "automation for setting GMX_GPU & cmake GPU detec...
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