- 06 Nov, 2015 5 commits
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peastman authored
addExtraParticles() can use bonds to select positions
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peastman authored
ForceField will not create duplicate constraints
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Peter Eastman authored
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peastman authored
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peastman authored
Fixed a race condition in energy computation
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- 05 Nov, 2015 7 commits
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Peter Eastman authored
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peastman authored
Update appveyor.yml
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peastman authored
Fix a handful of compiler warnings
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Jason Swails authored
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Jason Swails authored
These are worth fixing because they're in header files that are always included (rather than just hitting them at OpenMM compile-time). The SWIG interface now builds without warnings on my machine.
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peastman authored
Implemented CompoundIntegrator
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Peter Eastman authored
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- 04 Nov, 2015 5 commits
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Peter Eastman authored
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Peter Eastman authored
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Robert T. McGibbon authored
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Peter Eastman authored
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Peter Eastman authored
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- 03 Nov, 2015 6 commits
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Peter Eastman authored
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peastman authored
Added Context::getParameters()
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Peter Eastman authored
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peastman authored
Added neutralize option to addSolvent()
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Peter Eastman authored
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Peter Eastman authored
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- 02 Nov, 2015 6 commits
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peastman authored
CustomNonbodedForce interaction group validation now occurs during kernel initialization
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John Chodera (MSKCC) authored
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peastman authored
getState enforcePeriodicBox with triclinic unit cells
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Robert McGibbon authored
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Robert McGibbon authored
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peastman authored
[CMake] Fix OSX build
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- 01 Nov, 2015 6 commits
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Robert McGibbon authored
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Robert McGibbon authored
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Robert McGibbon authored
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Robert McGibbon authored
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Robert McGibbon authored
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Robert McGibbon authored
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- 31 Oct, 2015 1 commit
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John Chodera (MSKCC) authored
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- 30 Oct, 2015 4 commits
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peastman authored
Add OS X and CUDA builds to Travis-CI config
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peastman authored
[CMake] set CMAKE_OSX_SYSROOT
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peastman authored
Fix force group 31
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Robert McGibbon authored
For the CUDA build, the CUDA platform is compiled, but the tests are not run (no GPU). For OS X, the OpenCL platform is also compiled, but not tested (we skip Apple CPU OpenCL).
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