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Change builds that use failing docker containers
2020-07-01 Paul BauerChange builds that use failing docker containers
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2020-06-26 Paul BauerMake DSSP default path configurable
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2020-06-12 Paul BauerFix false initialization values in gmx hbond
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2020-06-11 Paul BauerFix false initialization values in gmx hbond
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2020-06-10 Paul BauerProper fix for gmx do_dssp
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2020-06-05 Paul BauerFix segmentation fault when reading energy terms
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2020-05-29 Paul BauerCorrect regular expression for clang-tidy.sh
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2020-05-22 Paul BauerAvoid parsing of fatalerror.cpp as lint failure
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2020-05-05 Paul BauerFix copyright
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2020-05-04 Paul BauerFix cmake error: Mixed styles of target_link_libraries...
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2020-05-01 Paul BauerPrepare for 2020.3
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2020-04-30 Paul BauerGROMACS version 2020.2
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2020-04-30 Paul BauerPrint base commit for source linters
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2020-04-30 Paul BauerFix incorrect header and linter scripts
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2020-04-30 Paul BauerDisallow combination of gcc > 9 and IBM_VSX
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2020-04-29 Paul BauerUse test conversion script from source
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2020-04-27 Paul BauerFix segmentation fault in do_dssp
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2020-04-27 Paul BauerBuild python package for documentation builds
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2020-04-27 Paul BauerFix warning for return type
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2020-04-27 Paul BauerFix bug in source verification on Windows
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2020-04-25 Paul BauerFix copyright header
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2020-04-25 Paul BauerUse branch point also for format and copyright check
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2020-04-24 Paul BauerFix parallel testing
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2020-04-22 Paul BauerCopy of CI from master to 2020
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2020-03-22 Paul BauerFix release builds on Gitlab with regressiontests
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2020-03-22 Paul BauerAdd Documentation build to script
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2020-03-20 Paul BauerAdd script to generate CI Docker files
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2020-03-19 Paul BauerAdd required Infrastructure for Gitlab merges
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2020-03-18 Paul BauerFix image mixup for GItlab doc builds
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2020-03-07 Paul BauerAdd clang-tidy script
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2020-03-03 Paul BauerPrepare for 2020.2
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2020-03-03 Paul BauerVersion 2020.1
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2020-03-03 Paul BauerAlways hash files when building from release tarball
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2020-03-02 Paul BauerAdd Cuda build to gitlab CI
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2020-03-02 Paul BauerRevert "Remove frozen atoms from VCM groups"
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2020-03-02 Paul BauerRemove frozen atoms from VCM groups
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2020-02-28 Paul BauerMerge branch release-2019 into release-2020
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2020-02-28 Paul BauerDefine all CPU NB kernels
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2020-02-28 Paul BauerVersion 2019.6
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2020-02-25 Paul BauerAvoid integer overflow in dispersion correction
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2020-02-25 Paul BauerRevert "Expose vsite counting"
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2020-02-24 Paul BauerFix clang-6 image template
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2020-01-29 Paul BauerWorkaround for Gitlab archive size
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2020-01-24 Paul BauerUse utf-8 for python file reading
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2020-01-21 Paul BauerFix documentation error with doxygen >1.8.16
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2020-01-17 Paul BauerActually fix Gitlab doc build
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2020-01-17 Paul BauerFix bad link in developer docs
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2020-01-16 Paul BauerFix nightly build failure on Gitlab
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2020-01-13 Paul BauerRevert "Exclude build-system files from CPack"
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2020-01-01 Paul BauerPrepare for 2020.1
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2020-01-01 Paul BauerGROMACS 2020 release
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2020-01-01 Paul BauerRevert "GROMACS 2020 release"
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2020-01-01 Paul BauerGROMACS 2020 release
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2019-12-30 Paul BauerFix build error with wrong name from cached cmake file
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2019-12-28 Paul BauerChange releng to give information about Gitlab
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2019-12-28 Paul BauerExtend information for GPU update
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2019-12-28 Paul BauerExclude build-system files from CPack
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2019-12-28 Paul BauerRemove membed from features
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2019-12-28 Paul BauerDeprecate support for Armv7
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2019-12-27 Paul BauerAdd copyright check and improve cache usage
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2019-12-27 Paul BauerMerge origin/release-2019 into release-2020
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2019-12-23 Paul BauerAdd files for Gitlab CI
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2019-12-23 Paul BauerPrepare for GROMACS 2019.6
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2019-12-23 Paul BauerGROMACS version 2019.5
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2019-12-23 Paul BauerRevert "Fix that tests intended for multiple ranks...
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2019-12-20 Paul BauerFix wrong header in release notes
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2019-12-20 Paul BauerGROMACS 2020 release candidate
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2019-12-19 Paul BauerFix regressiontests failing with ctest
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2019-12-18 Paul BauerAdd ability to set OMP and tMPI thread for ctest
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2019-12-18 Paul BauerIgnore build host for CI builds
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2019-12-17 Paul BauerTest parallel mpi only with openmp
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2019-12-17 Paul BauerSet correct dependency for doc build on gmxapi
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2019-12-17 Paul BauerFix compiler warning about extra ;
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2019-12-17 Paul BauerFix formatting error
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2019-12-16 Paul BauerFix torsion angle calculation
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2019-12-13 Paul BauerCheck for using correct hwloc headers and runtime
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2019-12-03 Paul BauerThird beta release of GROMACS 2020
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2019-12-03 Paul BauerRevert "Enable GPU update with DD when GPU comm features...
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2019-12-03 Paul BauerFix nightly build by correctly defining several
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2019-12-02 Paul BauerSet update to run on GPU by default if possible
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2019-12-01 Paul BauerUse DOI for citing in reference manual section
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2019-11-29 Paul BauerFix unaligned access with AVX512
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2019-11-29 Paul BauerFix build error without thread or regular mpi
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2019-11-28 Paul BauerCheck for using correct hwloc headers and runtime
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2019-11-28 Paul BauerFix postsubmit
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2019-11-26 Paul BauerFix unused variable warning in ewald code
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2019-11-20 Paul BauerMerge 'origin/release-2019' into release-2020
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2019-11-14 Paul BauerFix formatting error
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2019-11-13 Paul BauerAdd build to run clang-format update on Jenkins
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2019-11-12 Paul BauerIndicate which versions are no longer supported
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2019-11-07 Paul BauerApply clang-format to source tree
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2019-11-04 Paul BauerAdd build for clang-format
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2019-11-04 Paul BauerSplit up source code formatting scripts
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2019-11-01 Paul BauerSecond beta release of GROMACS 2020
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2019-11-01 Paul BauerPrepare for 2020 beta 2
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2019-11-01 Paul BauerAdd validation of tarball builds
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2019-10-31 Paul BauerUse type of explicit size in inmemoryserializer
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2019-10-29 Paul BauerMerge "Merge branch 'release-2019' into master"
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2019-10-29 Paul BauerMerge branch 'release-2019' into master
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2019-10-18 Paul BauerUse clang-tidy-8
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