Commits · 402f5585ff877251e879b4d6b8a8b692251408d2 · 郑智淋 / lammps · GitLab

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Dec 20, 2019
- Merge pull request #1795 from jrgissing/bond/react-chiral_centers · 402f5585
  Axel Kohlmeyer authored Dec 19, 2019
  402f5585
- Merge pull request #1816 from stanmoore1/kk_min_fix · 5a2074cc
  Axel Kohlmeyer authored Dec 19, 2019
  5a2074cc
- Merge pull request #1807 from ndtrung81/gpu-readme-update · 8283e68c
  Axel Kohlmeyer authored Dec 19, 2019
  8283e68c
- Merge pull request #1812 from ohenrich/user-cgdna · 27180e0b
  Axel Kohlmeyer authored Dec 19, 2019
  27180e0b
- Merge pull request #1813 from wmbrownIntel/user-intel-tri-fix · 6192741f
  Axel Kohlmeyer authored Dec 19, 2019
  6192741f
- Fix issue in Kokkos minimize · 7d167833
  Stan Moore authored Dec 19, 2019
  
  7d167833
Dec 18, 2019
- Added oxRNA2 files to .gitignore · d05f32d1
  Oliver Henrich authored Dec 18, 2019
  
  d05f32d1
- Bug fix for USER-INTEL package with triclinic neighbor builds. · 3be04e46
  Michael Brown authored Dec 18, 2019
  
  3be04e46
- Corrected the wrong use of the stubs path in -rpath · 4c3ec145
  Trung Nguyen authored Dec 17, 2019
  
  4c3ec145
Dec 14, 2019
- Merge pull request #1796 from athomps/compute-snap-tweak · 6c3161cb
  Richard Berger authored Dec 13, 2019
  6c3161cb
Dec 13, 2019
- Merge pull request #1794 from yafshar/master · 8030ff25
  Richard Berger authored Dec 12, 2019
  8030ff25
- Mark LMP_NO_SSL_CHECK and LMP_DEBUG_CURL as advanced options · 1f9f85e7
  Richard Berger authored Dec 12, 2019
  
  1f9f85e7
- Certificate Verification · b0d0037f
  Yaser Afshar authored Dec 12, 2019
  b0d0037f
- Merge pull request #1806 from akohlmey/mpi-info-in-help · a1e49ece
  Richard Berger authored Dec 12, 2019
  a1e49ece
- Merge pull request #1802 from rbberger/small-fixes · 96f75c7b
  Richard Berger authored Dec 12, 2019
  96f75c7b
Dec 12, 2019
- More minor update to README · 7e8a04d9
  Trung Nguyen authored Dec 12, 2019
  
  7e8a04d9
- Update fix_bond_react.rst · bde8b57f
  jrgissing authored Dec 11, 2019
  
  bde8b57f
- Updated README and added -L$(CUDA_HOME)/lib64/stubs to the Makefile's · 99ba15bf
  Trung Nguyen authored Dec 11, 2019
  
  99ba15bf
- Merge pull request #1803 from stanmoore1/kk_mpi · 5e4e6b28
  Richard Berger authored Dec 11, 2019
  5e4e6b28
Dec 11, 2019
- remove unused variable · 5e983b89
  Axel Kohlmeyer authored Dec 11, 2019
  
  5e983b89
- refactor MPI library info query so it can be added to -help flag output · 876032b7
  Axel Kohlmeyer authored Dec 11, 2019
  
  876032b7
- Remove outdated package.txt · e0a771d5
  Richard Berger authored Dec 10, 2019
  
  e0a771d5
- Don't change comm flags when there is only 1 MPI rank · fba97b94
  Stan Moore authored Dec 10, 2019
  
  fba97b94
- Merge pull request #1804 from ohenrich/user-cgdna · a6a35427
  Richard Berger authored Dec 10, 2019
  a6a35427
Dec 10, 2019
- Added oxRNA2 files to Install.sh script · bf1ee204
  Oliver Henrich authored Dec 10, 2019
  
  bf1ee204
- Fix issues with CUDA-aware MPI · 1b9214c3
  Stan Moore authored Dec 09, 2019
  
  1b9214c3
Dec 07, 2019
- Fix whitespace · 00547d90
  Richard Berger authored Dec 06, 2019
  
  00547d90
- Add false positives to spell check · 2d4d0752
  Richard Berger authored Dec 06, 2019
  
  2d4d0752
- Merge pull request #1772 from ohenrich/user-cgdna · e68824a3
  Richard Berger authored Dec 06, 2019
  e68824a3
Dec 05, 2019
- Merge pull request #1674 from rbberger/library_interface_update · b1668f28
  Richard Berger authored Dec 04, 2019
  b1668f28
Dec 04, 2019
- Merge branch 'master' into library_interface_update · e08ba3f1
  Richard Berger authored Dec 03, 2019
  
  e08ba3f1
Dec 03, 2019
- Fixed error in compute snap for quadratic and add log files for regression testing · 7233c3fe
  Aidan Thompson authored Dec 02, 2019
  
  7233c3fe
- Update Errors_messages.rst · e69e96ff
  jrgissing authored Dec 02, 2019
  
  e69e96ff
- chiral centers docs · 28fda045
  jrgissing authored Dec 02, 2019
  
  28fda045
- correct image atom mistake · 4cb797e6
  jrgissing authored Dec 02, 2019
  
  4cb797e6
- add option to enforce atom chirality · 819fe9ec
  jrgissing authored Dec 02, 2019
  
  819fe9ec
Dec 02, 2019
- Merge pull request #1792 from akohlmey/library-define-fix · 1d928409
  Richard Berger authored Dec 02, 2019
  1d928409
- angle constraint bugfix · 36e10251
  jrgissing authored Dec 02, 2019
  36e10251
- Merge pull request #1786 from rbberger/doc_command_tables · 2f4adfc0
  Richard Berger authored Dec 02, 2019
  2f4adfc0
- Fix trailing whitespace · dfcb4edc
  Richard Berger authored Dec 01, 2019
  
  dfcb4edc

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