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Print base commit for source linters
2020-04-29
Paul Bauer
Print base commit for source linters
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2020-04-23
Paul Bauer
Use branch point also for format and copyright check
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2020-04-23
Paul Bauer
Make clang-tidy script more robust
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2020-04-23
Paul Bauer
Fix parallel testing
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2020-04-20
Paul Bauer
Make tests check code for warnings same as the main...
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2020-04-17
Paul Bauer
Fix check source not parsing errors and warnings correctly
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2020-04-16
Paul Bauer
Use GPU resources for build types again
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2020-04-13
Paul Bauer
The ugliest hack to fix rebase issues ever
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2020-04-13
Paul Bauer
Fix clang-tidy script and code issue
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2020-04-11
Paul Bauer
Add Image for GCC 7 and AMD OpenCL
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2020-04-09
Paul Bauer
Add clang-tidy script
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2020-04-06
Paul Bauer
Add AMD image build, v2
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2020-03-23
Paul Bauer
Fix release builds on Gitlab with regressiontests
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2020-03-21
Paul Bauer
Add Documentation build to script
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2020-03-19
Paul Bauer
Add script to generate CI Docker files
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2020-03-09
Paul Bauer
Fix wrong Docker images in doc builds
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2020-03-06
Paul Bauer
Fix Gitlab build issues
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2020-03-04
Paul Bauer
Merge "Merge branch release-2020 into master"
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2020-03-04
Paul Bauer
Merge branch release-2020 into master
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2020-03-03
Paul Bauer
Prepare for 2020.2
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2020-03-03
Paul Bauer
Version 2020.1
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2020-03-03
Paul Bauer
Always hash files when building from release tarball
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2020-03-02
Paul Bauer
Add Cuda build to gitlab CI
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2020-03-02
Paul Bauer
Revert "Remove frozen atoms from VCM groups"
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2020-03-02
Paul Bauer
Remove frozen atoms from VCM groups
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2020-02-28
Paul Bauer
Merge branch release-2019 into release-2020
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2020-02-28
Paul Bauer
Define all CPU NB kernels
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2020-02-28
Paul Bauer
Version 2019.6
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2020-02-25
Paul Bauer
Avoid integer overflow in dispersion correction
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2020-02-25
Paul Bauer
Revert "Expose vsite counting"
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2020-02-24
Paul Bauer
Fix clang-6 image template
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2020-02-21
Paul Bauer
Fix Gitlab doc build
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2020-02-05
Paul Bauer
Use more MDLogger in preprocessing
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2020-01-31
Paul Bauer
Use MDLogger in grompp
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2020-01-31
Paul Bauer
Start using MDLogger in gmxpreprocess
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2020-01-29
Paul Bauer
Workaround for Gitlab archive size
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2020-01-29
Paul Bauer
Add replacement for symbol table
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2020-01-28
Paul Bauer
Merge branch origin/release-2020 into master
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2020-01-24
Paul Bauer
Add cool quotes
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2020-01-24
Paul Bauer
Use utf-8 for python file reading
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2020-01-21
Paul Bauer
Fix documentation error with doxygen >1.8.16
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2020-01-17
Paul Bauer
Actually fix Gitlab doc build
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2020-01-17
Paul Bauer
Fix bad link in developer docs
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2020-01-16
Paul Bauer
Fix nightly build failure on Gitlab
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2020-01-15
Paul Bauer
Update nonstd::optional
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2020-01-15
Paul Bauer
Allow access to optional outside libgromacs
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2020-01-14
Paul Bauer
Use utf-8 for python file reading
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2020-01-13
Paul Bauer
Revert "Exclude build-system files from CPack"
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2020-01-10
Paul Bauer
Fix compiler warnings on windows
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2020-01-07
Paul Bauer
Merge branch origin/release-2020 into master
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2020-01-07
Paul Bauer
Merge commit d30f2cb6 from release-2020 into master
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2020-01-01
Paul Bauer
Prepare for 2020.1
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2020-01-01
Paul Bauer
GROMACS 2020 release
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2020-01-01
Paul Bauer
Revert "GROMACS 2020 release"
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2020-01-01
Paul Bauer
GROMACS 2020 release
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2019-12-30
Paul Bauer
Fix build error with wrong name from cached cmake file
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2019-12-28
Paul Bauer
Change releng to give information about Gitlab
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2019-12-28
Paul Bauer
Extend information for GPU update
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2019-12-28
Paul Bauer
Exclude build-system files from CPack
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2019-12-28
Paul Bauer
Remove membed from features
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2019-12-28
Paul Bauer
Deprecate support for Armv7
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2019-12-27
Paul Bauer
Add copyright check and improve cache usage
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2019-12-27
Paul Bauer
Merge origin/release-2019 into release-2020
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2019-12-23
Paul Bauer
Add files for Gitlab CI
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2019-12-23
Paul Bauer
Prepare for GROMACS 2019.6
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2019-12-23
Paul Bauer
GROMACS version 2019.5
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2019-12-23
Paul Bauer
Revert "Fix that tests intended for multiple ranks...
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2019-12-20
Paul Bauer
Further updates to Gitlab CI
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2019-12-20
Paul Bauer
Fix wrong header in release notes
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2019-12-20
Paul Bauer
GROMACS 2020 release candidate
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2019-12-19
Paul Bauer
Fix regressiontests failing with ctest
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2019-12-18
Paul Bauer
Add ability to set OMP and tMPI thread for ctest
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2019-12-18
Paul Bauer
Ignore build host for CI builds
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2019-12-18
Paul Bauer
Add ability to set OMP and tMPI thread for ctest
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2019-12-17
Paul Bauer
Test parallel mpi only with openmp
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2019-12-17
Paul Bauer
Set correct dependency for doc build on gmxapi
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2019-12-17
Paul Bauer
Fix compiler warning about extra ;
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2019-12-17
Paul Bauer
Fix formatting error
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2019-12-16
Paul Bauer
Fix torsion angle calculation
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2019-12-15
Paul Bauer
Ignore build host for CI builds
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2019-12-13
Paul Bauer
Set correct dependency for doc build on gmxapi
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2019-12-13
Paul Bauer
Fix compiler warning about extra ;
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2019-12-13
Paul Bauer
Check for using correct hwloc headers and runtime
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2019-12-12
Paul Bauer
Merge branch 'origin/release-2020' into master
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2019-12-11
Paul Bauer
Update Gitlab CI to latest fixes
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2019-12-11
Paul Bauer
Test parallel mpi only with openmp
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2019-12-09
Paul Bauer
Hopefully final gitlab CI fix
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2019-12-09
Paul Bauer
Move doc build in gitlab to post-test stage
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2019-12-09
Paul Bauer
Even more gitlab CI fixes
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2019-12-09
Paul Bauer
More fixes to gitlab CI files
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2019-12-09
Paul Bauer
Fix error in gitlab CI file
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2019-12-06
Paul Bauer
Add files for gitlab ci testing
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2019-12-03
Paul Bauer
Third beta release of GROMACS 2020
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2019-12-03
Paul Bauer
Revert "Enable GPU update with DD when GPU comm features...
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2019-12-03
Paul Bauer
Fix nightly build by correctly defining several
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2019-12-02
Paul Bauer
Set update to run on GPU by default if possible
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2019-12-01
Paul Bauer
Use DOI for citing in reference manual section
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2019-11-30
Paul Bauer
Merge origin/release-2020 into master
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2019-11-29
Paul Bauer
Fix unaligned access with AVX512
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2019-11-29
Paul Bauer
Fix build error without thread or regular mpi
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