alexxy/gromacs.git
2013-05-16 David van der... Fixed two compilation issues.
2013-05-02 Mark AbrahamMerge "Improve master-specific CMake behavior."
2013-05-01 David van der... Merge "Updated source for Van der Waals radii."
2013-04-29 Teemu MurtolaRemove gmx_ana_index_t::name and unused code.
2013-04-29 Christoph JunghansMerge "Fix another bug in selection subexpression handl...
2013-04-29 Christoph JunghansMerge "Fix bug in selection subexpression handling."
2013-04-25 David van der... Updated source for Van der Waals radii.
2013-04-17 Teemu MurtolaAdd check for empty selections.
2013-04-17 Teemu MurtolaImplement remaining SelectionOption flags.
2013-04-12 David van der... Merge "Add histogram output for 'gmx gangle'."
2013-04-10 Teemu MurtolaFix another bug in selection subexpression handling.
2013-04-07 Teemu MurtolaFix bug in selection subexpression handling.
2013-03-26 Teemu MurtolaImprove master-specific CMake behavior.
2013-03-26 Teemu MurtolaAdd histogram output for 'gmx gangle'.
2013-03-24 Teemu MurtolaMerge libgmxana into libgromacs.
2013-03-22 Roland SchulzFix problems with intel-mpi
2013-03-22 Teemu MurtolaMerge "Merge release-4-6 into master"
2013-03-20 Roland SchulzMerge release-4-6 into master
2013-03-08 Teemu MurtolaBetter test assertions for exceptions.
2013-03-07 Teemu MurtolaImprove enum option interface.
2013-03-07 Teemu MurtolaMore flexible handling of enum option descriptions.
2013-03-07 Teemu MurtolaFix copyright notices for new C++ code.
2013-03-07 Teemu MurtolaUpdate my e-mail address on author lines.
2013-03-07 Teemu MurtolaMerge "Uncrustify template.cpp and selection.cpp."
2013-03-07 Teemu MurtolaMerge "Merge release-4-6 into master"
2013-03-06 Roland SchulzMerge "fixed PME time print with -ntomp_pme != -ntomp...
2013-03-05 Mark AbrahamNew patch release 4.6.1
2013-03-05 Mark AbrahamFix automated regression testing GMXLIB value
2013-03-05 Berk Hessfixed bug with DD cut-off check and PME DLB
2013-03-05 Mark AbrahamFix regressiontests automated download
2013-03-05 Berk Hessfixed recent bug with sorting atoms for GPUs
2013-03-05 Mark AbrahamUpdate shell completions
2013-03-05 Mark AbrahamUpdate outdated admin things
2013-03-05 Justin LemkulFixes for install guide page.
2013-03-05 Mark AbrahamUpdated install guide
2013-03-05 Mark AbrahamWarn if X11 was not found and the user wanted it
2013-03-02 Christoph JunghansMerge "Uncrustified code changes since 4.6" into releas...
2013-02-28 Peter KassonDeclaration-definition consistency nbxn_cuda_wait_gpu.
2013-02-26 Berk Hessfixed PME time print with -ntomp_pme != -ntomp
2013-02-26 Roland SchulzMerge release-4-6 into master
2013-02-26 Christoph JunghansMerge "Merge release-4-6 into master"
2013-02-26 Mark AbrahamUncrustified code changes since 4.6
2013-02-25 Teemu MurtolaUncrustify template.cpp and selection.cpp.
2013-02-25 Michael Shirtsfix imcompatibility with tpr vers<64 with free energy...
2013-02-20 Christoph JunghansBump shared object version to 8
2013-02-20 Berk Hessfixed issues with FEP soft-core and cut-off's
2013-02-20 Mark AbrahamMerge release-4-5-patches into release-4-6
2013-02-18 Berk Hessfixed GPU particle gridding performance issue
2013-02-18 Carsten KutznerMade g_tune_pme work with 4.6 if user sets "-p" command...
2013-02-18 Mark AbrahamFix CMake namespace pollution
2013-02-18 Roland SchulzIssue errors/warnings for ICC before 12.0.0
2013-02-16 Roland SchulzAdd missing include
2013-02-15 Michael Shirtsbugfix for md-vv + nose-hoover + (nstcalcenergy > nsttc...
2013-02-15 Mark AbrahamUse explicit kernel pointer typecasts
2013-02-15 Mark AbrahamMerge "Minor fixes to Verlet kernels" into release-4-6
2013-02-15 Mark AbrahamMerge "improved PME load balancing reporting" into...
2013-02-15 Mark AbrahamMerge "Re-generated group kernels" into release-4-6
2013-02-15 Mark AbrahamMerge "Unwinds flag dependencies in g_order." into...
2013-02-15 David van der... Merge "Fixed an initialization issue in gmx_dipoles...
2013-02-15 Mark AbrahamMerge "use legacy CUDA non-bonded kernels only on Fermi...
2013-02-15 Mark AbrahamMerge "More descriptive Verlet kernel macro parameter...
2013-02-15 Sander PronkFixed an initialization issue in gmx_dipoles.
2013-02-15 Berk Hessimproved PME load balancing reporting
2013-02-15 Mark AbrahamMinor fixes to Verlet kernels
2013-02-15 Peter KassonUnwinds flag dependencies in g_order.
2013-02-15 Mark AbrahamMerge "Fix and add Verlet kernel error messages" into...
2013-02-13 Teemu MurtolaFix velocity and force evaluation for empty selections.
2013-02-13 Teemu MurtolaChange ConstArrayRef constructor argument order.
2013-02-13 Teemu MurtolaAdd continuous array accessors for selection data.
2013-02-13 Teemu MurtolaAdd tests for selection mass evaluation and fix it.
2013-02-13 Sander PronkMerge "Fix code bug with thread-MPI on PowerPC with...
2013-02-13 Roland SchulzMerge "Fixed the MPI recognition string in g_tune_pme...
2013-02-13 Roland SchulzMerge "improve setup of multiple tf tables" into releas...
2013-02-13 Roland SchulzMerge release-4-6 into master
2013-02-13 Roland SchulzMerge release-4-6 into master
2013-02-13 Roland SchulzCode beautification with uncrustify
2013-02-13 David van der... Plain text quotes.
2013-02-13 Mark AbrahamFix code bug with thread-MPI on PowerPC with xlc
2013-02-13 Mark AbrahamMore descriptive Verlet kernel macro parameter names
2013-02-13 Mark AbrahamFix and add Verlet kernel error messages
2013-02-13 Mark AbrahamRe-generated group kernels
2013-02-13 Sander PronkAdded extra check in for setaffinity support.
2013-02-13 Carsten KutznerFixed the MPI recognition string in g_tune_pme
2013-02-13 Roland SchulzMerge "Updated FindGSL.cmake to version written by...
2013-02-12 Mark AbrahamMerge "PME-only counters are now reset with -maxh ...
2013-02-12 Christoph JunghansUpdated FindGSL.cmake to version written by me.
2013-02-12 Mark AbrahamMerge "fixed bug with sd integrator and OpenMP threadin...
2013-02-12 Mark AbrahamMerge "Fix CUDA_HOST_COMPILER flag name" into release-4-6
2013-02-12 Mark AbrahamMerge "Remove duplicated clang section"
2013-02-12 Mark AbrahamMerge "Manual reformatting in preparation for uncrustify."
2013-02-12 Mark AbrahamMerge "Fix gmxcheck target"
2013-02-10 Teemu MurtolaManual reformatting in preparation for uncrustify.
2013-02-10 Szilárd Pálluse legacy CUDA non-bonded kernels only on Fermi
2013-02-09 Roland SchulzMerge "Typo fix" into release-4-6
2013-02-09 Mark AbrahamTypo fix
2013-02-08 Roland SchulzFix CUDA_HOST_COMPILER flag name
2013-02-08 Roland SchulzRemove duplicated clang section
2013-02-08 Roland SchulzRemove dummy.cpp
2013-02-08 Mark AbrahamMerge "added back cuda.h includes to fix missing CUDA_V...
2013-02-08 Mark AbrahamMerge "Fixed flop counting for generic cg/adress kernel...
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