Commits · 050e1262842e1d827326b96f9175acc55531d149 · tsoc / openmm

06 Feb, 2015 1 commit
- Bug fixes to triclinic boxes · 050e1262
  Peter Eastman authored Feb 05, 2015
  
  050e1262
05 Feb, 2015 2 commits
- Finished CUDA implementation of triclinic boxes for AmoebaMultipoleForce · 5b846af6
  Peter Eastman authored Feb 05, 2015
  
  5b846af6
- Continuing CUDA implementation of triclinic boxes for AmoebaMultipoleForce · 3b91c945
  Peter Eastman authored Feb 05, 2015
  
  3b91c945
04 Feb, 2015 1 commit
- Began CUDA implementation of triclinic boxes for AmoebaMultipoleForce · c83f2a12
  Peter Eastman authored Feb 04, 2015
  
  c83f2a12
03 Feb, 2015 1 commit
- Bug fixes to triclinic boxes for reference AmoebaMultipoleForce · 82e118fb
  Peter Eastman authored Feb 03, 2015
  
  82e118fb
22 Jan, 2015 1 commit
- Began implementing triclinic boxes for reference AmoebaMultipoleForce (not yet debugged) · 5e3a0a05
  Peter Eastman authored Jan 22, 2015
  
  5e3a0a05
14 Jan, 2015 1 commit
- Removed some unneeded code · 3b2579a5
  Peter Eastman authored Jan 14, 2015
  
  3b2579a5
08 Jan, 2015 4 commits
- Adjusted the tolerance on a test that was failing on some computers · 38acdd6e
  Peter Eastman authored Jan 08, 2015
  
  38acdd6e
- AmoebaVdwForce works with triclinic boxes · 46f7b76b
  Peter Eastman authored Jan 08, 2015
  
  46f7b76b
- Do not allow Ewald to be used with triclinic boxes, since it isn't implemented. · 53690fef
  Peter Eastman authored Jan 08, 2015
  
  53690fef
- OpenCL supports PME with triclinic boxes · 295ae001
  Peter Eastman authored Jan 07, 2015
  
  295ae001
07 Jan, 2015 3 commits
- Continuing OpenCL support for triclinic boxes · 9bcba51e
  Peter Eastman authored Jan 07, 2015
  
  9bcba51e
- Began implementing OpenCL support for triclinic boxes · 195bcecf
  Peter Eastman authored Jan 07, 2015
  
  195bcecf
- Fixed some methods that should have been marked const · 17c06daa
  Peter Eastman authored Jan 07, 2015
  
  17c06daa
06 Jan, 2015 2 commits
- CUDA support for PME with triclinic boxes · e7eb7852
  Peter Eastman authored Jan 06, 2015
  
  e7eb7852
- Continuing to implement CUDA support for triclinic boxes · 6eb302fb
  Peter Eastman authored Jan 05, 2015
  
  6eb302fb
05 Jan, 2015 1 commit
- Beginning of CUDA support for triclinic boxes · 61458a5f
  Peter Eastman authored Jan 05, 2015
  
  61458a5f
19 Dec, 2014 2 commits
- Use templates to improve performance when not using triclinic boxes · b3bab499
  peastman authored Dec 19, 2014
  
  b3bab499
- CPU PME works with triclinic boxes · f6aae604
  peastman authored Dec 18, 2014
  
  f6aae604
17 Dec, 2014 1 commit
- Continuing to implement triclinic boxes in CPU platform · 78e5f13a
  peastman authored Dec 16, 2014
  
  78e5f13a
16 Dec, 2014 1 commit
- CpuNeighborList correctly handles triclinic boxes · 4193a416
  peastman authored Dec 16, 2014
  
  4193a416
11 Dec, 2014 1 commit
- ReferenceNeighborList correctly handles triclinic boxes · 34ddae96
  peastman authored Dec 11, 2014
  
  34ddae96
10 Dec, 2014 1 commit
- Began implementing triclinic boxes for CPU platform · 4b6f53e5
  peastman authored Dec 10, 2014
  
  4b6f53e5
09 Dec, 2014 1 commit
- Implemented PME for triclinic boxes in reference platform · 9c6011f8
  peastman authored Dec 09, 2014
  
  9c6011f8
03 Dec, 2014 1 commit
- Continuing to implement triclinic boxes in reference platform · 9e2b5a12
  peastman authored Dec 02, 2014
  
  9e2b5a12
02 Dec, 2014 2 commits
- Began implementing triclinic boxes in reference platform · e2977b91
  peastman authored Dec 02, 2014
  
  e2977b91
- Updated API and documentation to permit triclinic boxes · fa283744
  peastman authored Dec 01, 2014
  
  fa283744
26 Nov, 2014 5 commits
- Merge pull request #744 from peastman/master · 066cdd60
  peastman authored Nov 26, 2014
```
Workaround for compiler bug in Visual Studio
```
  066cdd60
- Fixed line endings · a55b34ee
  peastman authored Nov 26, 2014
  
  a55b34ee
- Workaround for compiler bug in Visual Studio · 4b5f48ee
  peastman authored Nov 26, 2014
  
  4b5f48ee
- Merge pull request #743 from peastman/master · 12dbd216
  peastman authored Nov 25, 2014
```
Prevent running tests on unsupported CPUs
```
  12dbd216
- Prevent running tests on unsupported CPUs · 59484a6f
  peastman authored Nov 25, 2014
  
  59484a6f
19 Nov, 2014 8 commits
- Merge pull request #740 from peastman/test · bcef4de7
  peastman authored Nov 19, 2014
```
Updated instructions on running the test installation script
```
  bcef4de7
- Updated instructions on running the test installation script · b7730b84
  peastman authored Nov 19, 2014
  
  b7730b84
- Merge pull request #739 from swails/conda-testing · ab767c49
  peastman authored Nov 19, 2014
```
Conda testing
```
  ab767c49
- Add "python -m simtk.testInstallation" to .travis.yml · 3b85cf43
  Jason Swails authored Nov 19, 2014
  
  3b85cf43
- Add docstring to test function. Convert all raised exceptions raised in · 9f8e7335
  Jason Swails authored Nov 19, 2014
```
run_tests to TestingError so users only ever have one exception to catch.
```
  9f8e7335
- Further formatting tweaks. · ab81ee06
  Jason Swails authored Nov 19, 2014
  
  ab81ee06
- Tweak error message formatting. · 612ca414
  Jason Swails authored Nov 19, 2014
  
  612ca414
- Apparently "from XXX import *" is only allowed at the module level (I get a · 64ebc791
  Jason Swails authored Nov 19, 2014
```
SyntaxWarning otherwise). So move those imports back to the module level and
save any error messages for when the tests are actually run (if ever).

python -m simtk.testInstallation

runs the tests, whereas

python -c "import simtk.testInstallation"

does not.
```
  64ebc791