Commits · ec799972ac2b1c784898b6a7fbec41eabde65958 · tsoc / openmm

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25 Sep, 2015 2 commits
- Merge pull request #1150 from peastman/cpuopt · ec799972
  peastman authored Sep 24, 2015
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Optimizations to CPU platform
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  ec799972
- Fixed compilation error on Windows · 10ceb969
  peastman authored Sep 24, 2015
  
  10ceb969
24 Sep, 2015 6 commits
- Optimizations to CPU platform · 02825c46
  peastman authored Sep 24, 2015
  
  02825c46
- Merge pull request #1147 from peastman/version · 1f58fdeb
  peastman authored Sep 24, 2015
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Updated version number to 7.0
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  1f58fdeb
- Updated version number to 7.0 · 60d3ef2d
  Peter Eastman authored Sep 24, 2015
  
  60d3ef2d
- Merge pull request #1146 from peastman/params · 289a30c3
  peastman authored Sep 24, 2015
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Added default values for some arguments
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  289a30c3
- Added default values for some arguments · 1d5c7417
  Peter Eastman authored Sep 24, 2015
  
  1d5c7417
- Merge pull request #1144 from peastman/pi · 260d1203
  peastman authored Sep 23, 2015
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Fixed compilation error on Windows
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  260d1203
23 Sep, 2015 8 commits
- Fixed compilation error on Windows · 97f5e611
  Peter Eastman authored Sep 23, 2015
  
  97f5e611
- Merge pull request #1143 from peastman/variables · 11d2d8ae
  peastman authored Sep 23, 2015
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Added error checking for illegal variable names
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  11d2d8ae
- Added error checking for illegal variable names · 213fbc03
  Peter Eastman authored Sep 23, 2015
  
  213fbc03
- Merge pull request #1142 from peastman/tests · 5e1a87fb
  peastman authored Sep 23, 2015
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Refactored test cases
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  5e1a87fb
- Fixed a failing test case · cece0cdb
  Peter Eastman authored Sep 23, 2015
  
  cece0cdb
- Finished refactoring test cases · 8b5d3dc0
  Peter Eastman authored Sep 23, 2015
  
  8b5d3dc0
- Merge pull request #1140 from peastman/energy · b11af401
  peastman authored Sep 23, 2015
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Changes to generating nonbonded kernels
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  b11af401
- Continuing to refactor tests · 2f553a66
  Peter Eastman authored Sep 23, 2015
  
  2f553a66
22 Sep, 2015 2 commits
- Continuing to refactor tests · 4ed151e1
  Peter Eastman authored Sep 22, 2015
  
  4ed151e1
- Continuing to refactor tests · ccd811da
  Peter Eastman authored Sep 22, 2015
  
  ccd811da
21 Sep, 2015 4 commits
- Changes to generating nonbonded kernels · a47300e6
  Peter Eastman authored Sep 21, 2015
  
  a47300e6
- Began refactoring of tests to eliminate duplicated code · a5a52dd1
  Peter Eastman authored Sep 21, 2015
  
  a5a52dd1
- Merge pull request #1139 from peastman/periodic · a2d5b985
  peastman authored Sep 21, 2015
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Fixed CustomExternalForce::usesPeriodicBoundaryConditions()
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  a2d5b985
- Fixed CustomExternalForce::usesPeriodicBoundaryConditions() · 9e1145ac
  peastman authored Sep 21, 2015
  
  9e1145ac
20 Sep, 2015 1 commit
- Merge pull request #1138 from rmcgibbo/typemap-vecvec · 2dee12e6
  peastman authored Sep 19, 2015
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Typemaps
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  2dee12e6
19 Sep, 2015 1 commit
- Add typemaps · 0c453714
  Robert McGibbon authored Sep 19, 2015
  
  0c453714
18 Sep, 2015 5 commits
- Merge pull request #1137 from peastman/periodic · 4c696473
  peastman authored Sep 18, 2015
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Created periodicdistance() function for CustomExternalForce
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  4c696473
- Created OpenCL implementation of periodicdistance() · eaef52d9
  peastman authored Sep 18, 2015
  
  eaef52d9
- Finished CUDA implementation of periodicdistance() · 91a8cc49
  Peter Eastman authored Sep 18, 2015
  
  91a8cc49
- Began CUDA implementation of periodicdistance() function for CustomExternalForce · 0b77ab91
  peastman authored Sep 18, 2015
  
  0b77ab91
- Reference implementation of periodicdistance() function for CustomExternalForce · cceb3171
  peastman authored Sep 18, 2015
  
  cceb3171
15 Sep, 2015 2 commits
- Merge pull request #1135 from rmcgibbo/typemaps2 · 69fd88d7
  peastman authored Sep 15, 2015
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More typechecks
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  69fd88d7
- More typechecks · fbf13b1d
  Robert McGibbon authored Sep 01, 2015
  
  fbf13b1d
11 Sep, 2015 5 commits
- Merge pull request #1133 from rafwiewiora/amberffconv · 992487c6
  peastman authored Sep 11, 2015
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Resolve sigma = 0 problems from processAmberForceField
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  992487c6
- modify processAmberForceField.py to resolve the sigma = 0 problems · e060e7c4
  Rafal P. Wiewiora authored Sep 11, 2015
  
  e060e7c4
- Merge pull request #1132 from peastman/tileorder · b9b2b7a3
  peastman authored Sep 11, 2015
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Minor optimization on AMD GPUs
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  b9b2b7a3
- Minor optimization on AMD GPUs · c400a83b
  peastman authored Sep 11, 2015
  
  c400a83b
- Merge pull request #1131 from peastman/cudabug · 8a76aa72
  peastman authored Sep 10, 2015
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Workaround for bug in CUDA 7.5
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  8a76aa72
10 Sep, 2015 4 commits
- Workaround for bug in CUDA 7.5 · 9a7d1e0d
  Peter Eastman authored Sep 10, 2015
  
  9a7d1e0d
- Merge pull request #1130 from peastman/platformenv · be1aaffd
  peastman authored Sep 10, 2015
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Created OPENMM_DEFAULT_PLATFORM environment variable
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  be1aaffd
- Created OPENMM_DEFAULT_PLATFORM environment variable · 3fa88060
  peastman authored Sep 10, 2015
  
  3fa88060
- Merge pull request #1129 from peastman/amoebamts · 119944af
  peastman authored Sep 10, 2015
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Use MTSIntegrator for AMOEBA benchmarks
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  119944af