Commits · 146b66bde013e5f25d6e7655f083f0e24488cbb5 · tsoc / openmm

22 Jan, 2014 3 commits
- Parallelized the initialization of positions and forces in the CPU platform · 146b66bd
  peastman authored Jan 22, 2014
  
  146b66bd
- Parallelized the computation of torsions with CPU platform · 543d51d7
  peastman authored Jan 22, 2014
  
  543d51d7
- Fixed errors in wrapper generation when using Visual Studio 2010 · 4f339321
  peastman authored Jan 22, 2014
  
  4f339321
17 Jan, 2014 3 commits
- Lots of documentation updates for 6.0 · 7b0faf6a
  peastman authored Jan 17, 2014
  
  7b0faf6a
- Updated version number to 6.0 · 99072608
  peastman authored Jan 17, 2014
  
  99072608
- Fixed an error in CMake script when compiling with clang · 55f008e3
  peastman authored Jan 16, 2014
  
  55f008e3
16 Jan, 2014 2 commits
- Ensure that PYTHON_EXECUTABLE is visible to all CMake scripts · 9e2c6b06
  Peter Eastman authored Jan 16, 2014
  
  9e2c6b06
- Fixed a test case that occasionally failed · feb0368f
  Peter Eastman authored Jan 15, 2014
  
  feb0368f
15 Jan, 2014 1 commit
- Test cases detect if CPU is not supported and exit rather than crashing · 9966f134
  Peter Eastman authored Jan 14, 2014
  
  9966f134
14 Jan, 2014 3 commits
- Fixed a compilation error when building wrappers · bd543402
  peastman authored Jan 14, 2014
  
  bd543402
- Merge pull request #286 from peastman/master · 901108a0
  peastman authored Jan 14, 2014
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Added methods for changing default parameters on barostats and thermostats
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  901108a0
- Added methods for changing default parameters on barostats and thermostats · df563967
  peastman authored Jan 14, 2014
  
  df563967
15 Jan, 2014 1 commit
- Workaround for bug in Visual Studio · 435be5e2
  peastman authored Jan 15, 2014
  
  435be5e2
14 Jan, 2014 5 commits
- Merge pull request #285 from peastman/master · 6341257a
  peastman authored Jan 14, 2014
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Workaround for bug in Visual Studio
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  6341257a
- Detect Visual Studio in a way that works correctly with NMake files · c285b600
  peastman authored Jan 13, 2014
  
  c285b600
- Detect Visual Studio in a way that works correctly with NMake files · 19dd114e
  peastman authored Jan 13, 2014
  
  19dd114e
- Merge pull request #284 from peastman/master · 75dc8532
  peastman authored Jan 13, 2014
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Detect Visual Studio in a way that works correctly with NMake files
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  75dc8532
- Merge pull request #283 from peastman/master · 9723e3b7
  peastman authored Jan 13, 2014
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Detect Visual Studio in a way that works correctly with NMake files
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  9723e3b7
11 Jan, 2014 3 commits
- Merge pull request #282 from peastman/master · f4545597
  peastman authored Jan 10, 2014
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Fixed a bug in CustomGBForce
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  f4545597
- Same bug fix as the previous commit, but for CUDA · 1e857c31
  peastman authored Jan 10, 2014
  
  1e857c31
- Fixed a bug in OpenCL implementation of CustomGBForce · 44e65cb1
  peastman authored Jan 10, 2014
  
  44e65cb1
10 Jan, 2014 3 commits
- Merge pull request #278 from peastman/progress · e32e1a61
  peastman authored Jan 10, 2014
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StateDataReport can report % progress, speed, and time to completion
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  e32e1a61
- Merge pull request #281 from peastman/master · db9528ca
  peastman authored Jan 10, 2014
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Updated Developer Guide for 6.0
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  db9528ca
- Updated Developer Guide for 6.0 · 8c918ca2
  peastman authored Jan 10, 2014
  
  8c918ca2
09 Jan, 2014 6 commits
- Merge pull request #280 from peastman/master · 8e24cfc9
  peastman authored Jan 09, 2014
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Fixed additional errors on Windows
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  8e24cfc9
- Bug fix · e14ab7b9
  peastman authored Jan 09, 2014
  
  e14ab7b9
- Fixed additional errors on Windows · 76d592d6
  Peter Eastman authored Jan 09, 2014
  
  76d592d6
- Fixed a bug that could potentially cause LJ energy to be nan · 5c983283
  peastman authored Jan 09, 2014
  
  5c983283
- Merge pull request #279 from peastman/master · d3469b87
  peastman authored Jan 08, 2014
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Optimizations to CPU GBSA
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  d3469b87
- Optimizations to CPU GBSA · cf52e69f
  peastman authored Jan 08, 2014
  
  cf52e69f
08 Jan, 2014 3 commits
- StateDataReport can report % progress, speed, and time to completion · 6c9b8cf1
  peastman authored Jan 08, 2014
  
  6c9b8cf1
- Merge pull request #277 from peastman/winvec · 6d356ddc
  peastman authored Jan 08, 2014
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Fixed lots of compilation errors on Windows
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  6d356ddc
- Fixed lots of compilation errors on Windows · 72e81e04
  Peter Eastman authored Jan 08, 2014
  
  72e81e04
07 Jan, 2014 7 commits
- Merge pull request #276 from peastman/master · a4f7ac48
  peastman authored Jan 07, 2014
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Very minor optimization
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  a4f7ac48
- Very minor optimization · 06db7ac4
  peastman authored Jan 07, 2014
  
  06db7ac4
- Merge pull request #275 from swails/master · 85020137
  peastman authored Jan 06, 2014
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Fixes salt concentration for GB with a cutoff
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  85020137
- Merge branch 'master' of https://github.com/swails/openmm · 2cbb8f43
  Jason Swails authored Jan 06, 2014
  
  2cbb8f43
- Merge branch 'master' of https://github.com/SimTk/openmm · 8b44287e
  Jason Swails authored Jan 06, 2014
  
  8b44287e
- Merge pull request #274 from peastman/sfmt · 291484f2
  peastman authored Jan 06, 2014
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Ensure SFMT data array is correctly aligned
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  291484f2
- Merge branch 'master' of http://github.com/SimTk/openmm · b3d93583
  Jason Swails authored Jan 06, 2014
  
  b3d93583