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alexxy/gromacs.git
2018-07-16 Roland SchulzWarn for type mismatch for gmx printf like functions 1/3 commit | commitdiff | tree | snapshot
2018-07-16 Mark AbrahamReplacement for pdb2gmx tests commit | commitdiff | tree | snapshot
2018-07-16 Roland SchulzEnable debug FP exceptions without TPI, not with TPI commit | commitdiff | tree | snapshot
2018-07-14 Roland SchulzMSVC: enable code analysis commit | commitdiff | tree | snapshot
2018-07-12 Roland SchulzFix clang-tidy cmake messages commit | commitdiff | tree | snapshot
2018-07-12 Roland SchulzFix attribute usage commit | commitdiff | tree | snapshot
2018-07-12 Roland SchulzTemporary disable armhpc-18.2 commit | commitdiff | tree | snapshot
2018-07-12 Roland SchulzRequire ICC 17.0.1 commit | commitdiff | tree | snapshot
2018-07-12 Mark AbrahamBump minimum MSVC version to 2017 commit | commitdiff | tree | snapshot
2018-07-11 Roland Schulzclang: undefined-reinterpret-cast, comma, extra-semi commit | commitdiff | tree | snapshot
2018-07-11 Roland SchulzFix custom build types with cmake 3.11 commit | commitdiff | tree | snapshot
2018-07-11 Roland SchulzClang warnings commit | commitdiff | tree | snapshot
2018-07-11 Mark AbrahamSplit TopologyInformation into its own header commit | commitdiff | tree | snapshot
2018-07-10 Mark AbrahamAdd infrastructure for tools cleanup commit | commitdiff | tree | snapshot
2018-07-10 Roland SchulzClang warnings: unreachable commit | commitdiff | tree | snapshot
2018-07-08 Mark AbrahamClarify the implementation of selection -ofpdb output commit | commitdiff | tree | snapshot
2018-07-06 Mark AbrahamUse fewer gcc-4.8 configurations commit | commitdiff | tree | snapshot
2018-07-06 Mark AbrahamFix warnings in internal xdr code commit | commitdiff | tree | snapshot
2018-07-06 Mark AbrahamMerge "Merge release-2018 into master" commit | commitdiff | tree | snapshot
2018-07-06 Roland SchulzFix AVX_512_KNL commit | commitdiff | tree | snapshot
2018-07-05 Roland SchulzFix compiler warnings in OCL commit | commitdiff | tree | snapshot
2018-07-04 Roland SchulzMerge release-2018 into master commit | commitdiff | tree | snapshot
2018-07-04 Roland SchulzEnable more warnings for Clang 6 commit | commitdiff | tree | snapshot
2018-07-04 Roland SchulzFix ManageLmfit commit | commitdiff | tree | snapshot
2018-07-03 Roland SchulzFix post-submit issues commit | commitdiff | tree | snapshot
2018-07-03 Mark AbrahamFix clang CUDA build commit | commitdiff | tree | snapshot
2018-07-03 Roland SchulzChange ArrayRef::size_type to signed commit | commitdiff | tree | snapshot
2018-07-03 Berk HessConvert gmx_hash_t to C++ commit | commitdiff | tree | snapshot
2018-07-03 Roland Schulzclang-tidy: misc-misplaced-widening-cast commit | commitdiff | tree | snapshot
2018-07-03 Roland Schulzclang-tidy: misc-misplaced-const commit | commitdiff | tree | snapshot
2018-07-03 Roland Schulzclang-tidy: more misc+readability commit | commitdiff | tree | snapshot
2018-07-03 Berk HessLocalize variables in dd_redistribute_cg() commit | commitdiff | tree | snapshot
2018-07-02 Berk HessConvert DD DLB cell size handling to C++ commit | commitdiff | tree | snapshot
2018-07-02 Mark AbrahamRemove some pieces from forcerec.h commit | commitdiff | tree | snapshot
2018-07-02 Berk HessFix recent bug with 2D/3D DLB commit | commitdiff | tree | snapshot
2018-07-01 Roland SchulzEnable clang-tidy NullDereference commit | commitdiff | tree | snapshot
2018-07-01 Roland Schulzclang-tidy: readability-non-const-parameter (2/2) commit | commitdiff | tree | snapshot
2018-07-01 Berk HessRemoved smalloc.h from many DD files commit | commitdiff | tree | snapshot
2018-06-30 Roland Schulzclang-tidy: misc-string-compare+perf-value-param commit | commitdiff | tree | snapshot
2018-06-29 Roland Schulzclang-tidy: readability-non-const-parameter (1/2) commit | commitdiff | tree | snapshot
2018-06-29 Berk HessConvert gmx_domdec_constraints_t to C++ commit | commitdiff | tree | snapshot
2018-06-29 Berk HessConvert gmx_domdec_specat_comm_t to C++ commit | commitdiff | tree | snapshot
2018-06-29 Berk HessInitialize DD DLB variable commit | commitdiff | tree | snapshot
2018-06-29 Berk HessNew quote from a referee commit | commitdiff | tree | snapshot
2018-06-29 Roland Schulzclang-tidy: misc-suspicious-missing-comma commit | commitdiff | tree | snapshot
2018-06-29 Roland Schulzclang-tidy: add modernize nullptr & emplace commit | commitdiff | tree | snapshot
2018-06-29 Mark AbrahamNew quote from ISC2018 commit | commitdiff | tree | snapshot
2018-06-29 Roland Schulzclang-tidy: readibility redundant commit | commitdiff | tree | snapshot
2018-06-29 Roland Schulzclang-tidy: misleading-indentation+noexcept-move commit | commitdiff | tree | snapshot
2018-06-29 Roland Schulzclang-tidy: Enable bugprone-integer-division commit | commitdiff | tree | snapshot
2018-06-29 Roland SchulzAdd clang-tidy to pre-submit commit | commitdiff | tree | snapshot
2018-06-28 Berk HessRename atomGroups in gmx_domdec_t to atomGrouping commit | commitdiff | tree | snapshot
2018-06-28 Berk HessClean up dd_move_cellx() commit | commitdiff | tree | snapshot
2018-06-28 Berk HessConvert gmx_domdec_sort_t to C++ commit | commitdiff | tree | snapshot
2018-06-28 Berk HessChange BlockRanges to class RangePartitioning commit | commitdiff | tree | snapshot
2018-06-28 Roland Schulzclang-tidy: 4 readability checks commit | commitdiff | tree | snapshot
2018-06-28 Roland Schulzclang-tidy: performance-type-promotion-in-math-fn commit | commitdiff | tree | snapshot
2018-06-28 Roland SchulzClang-tidy: enable further tests commit | commitdiff | tree | snapshot
2018-06-27 Berk HessFix bug with 2D/3D triclinic DD commit | commitdiff | tree | snapshot
2018-06-27 Berk HessBase vacuum DD on atom coordinates commit | commitdiff | tree | snapshot
2018-06-27 Berk HessAdd consistency check to DDAtomRanges commit | commitdiff | tree | snapshot
2018-06-27 Berk HessPartial conversion of gmx_domdec_comm_t to C++ commit | commitdiff | tree | snapshot
2018-06-27 Berk HessTemplate and overload dd_sendrecv functions commit | commitdiff | tree | snapshot
2018-06-27 Berk HessCorrect DD zone size loop bound commit | commitdiff | tree | snapshot
2018-06-25 Aleksei IupinovMove vectype_ops.clh into gpu_utils commit | commitdiff | tree | snapshot
2018-06-25 Aleksei IupinovMove the PME GPU kernel launch functions into pme-gpu... commit | commitdiff | tree | snapshot
2018-06-25 Mark AbrahamTest both internal and external clFFT build in Jenkins commit | commitdiff | tree | snapshot
2018-06-25 Mark AbrahamFix unused variable warnings commit | commitdiff | tree | snapshot
2018-06-24 Roland SchulzAllow GMX_OCL_DEBUG for any vendor commit | commitdiff | tree | snapshot
2018-06-23 Roland Schulzclang-tidy: Enable most bugprone checks commit | commitdiff | tree | snapshot
2018-06-23 Roland SchulzAllow to enable clang-tidy with GMX_CLANG_TIDY commit | commitdiff | tree | snapshot
2018-06-22 Mark AbrahamUpdate energy and trajectory frame types commit | commitdiff | tree | snapshot
2018-06-14 Mark AbrahamUpdated to prepare for 2018.3 release commit | commitdiff | tree | snapshot
2018-06-14 Mark AbrahamVersion 2018.2 commit | commitdiff | tree | snapshot
2018-06-14 Kevin BoydChanged documentation on common errors during minimization commit | commitdiff | tree | snapshot
2018-06-14 Berk HessMinimization now detects infinite forces commit | commitdiff | tree | snapshot
2018-06-14 Aleksei IupinovEnsure PME with OpenCL does not attempt to pin commit | commitdiff | tree | snapshot
2018-06-14 Berk HessIntroduced DDAtomRanges class commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamCall Constraints::setConstraints with other setup code commit | commitdiff | tree | snapshot
2018-06-13 Berk HessRemove LINCS prints to log file commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamFix premature reporting of action when GPUs are not... commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamUse initializer lists for Lincs and Task commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamUse more containers and views for constraints code commit | commitdiff | tree | snapshot
2018-06-13 Berk HessPartial conversion of gmx_domdec_t to C++ commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamUpdate top-level README commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamFixed documentation typo commit | commitdiff | tree | snapshot
2018-06-13 Mark AbrahamBump lmfit support to version 7 commit | commitdiff | tree | snapshot
2018-06-12 Berk HessAdd AWH continuation consistency checking commit | commitdiff | tree | snapshot
2018-06-12 Mark AbrahamMore fixes to suit gcc 8 for double build commit | commitdiff | tree | snapshot
2018-06-12 Mark AbrahamPrepare for GROMACS 2019 release notes commit | commitdiff | tree | snapshot
2018-06-12 David van der... Let gmx nmeig print thermochemistry. commit | commitdiff | tree | snapshot
2018-06-12 Szilárd PállAlso issue OMP_NUM_THREADS reading note to the log commit | commitdiff | tree | snapshot
2018-06-12 Viveca LindahlChanged histogram check interval for multidimensional... commit | commitdiff | tree | snapshot
2018-06-12 Berk HessAdd fatal error for inconsistent graph commit | commitdiff | tree | snapshot
2018-06-12 Berk HessAvoid COM removal moving frozen atoms commit | commitdiff | tree | snapshot
2018-06-12 Berk HessRemove constraint v correction for frozen atoms commit | commitdiff | tree | snapshot
2018-06-08 Paul BauerFix gmx solvate with multiple solvent molecule types commit | commitdiff | tree | snapshot
2018-06-07 Paul BauerChange use of t_inpfile to std::vector commit | commitdiff | tree | snapshot
2018-06-07 Paul BauerRemove macros in input file reading commit | commitdiff | tree | snapshot
2018-06-07 Aleksei IupinovCompile most of PME GPU host code with OpenCL commit | commitdiff | tree | snapshot
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