- 17 Dec, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 16 Dec, 2009 1 commit
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John Chodera authored
Fixed uninitialized value problem with setting box vectors. This caused sporadic multithreading issues on Linux platforms.
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- 15 Dec, 2009 2 commits
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Peter Eastman authored
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Christopher Bruns authored
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- 11 Dec, 2009 5 commits
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Peter Eastman authored
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Peter Eastman authored
Use a consistent (and more accurate) value for electric constant everywhere. Also cleaned up handling of constants and units in various places.
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 10 Dec, 2009 3 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 09 Dec, 2009 2 commits
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Peter Eastman authored
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Peter Eastman authored
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- 08 Dec, 2009 1 commit
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Peter Eastman authored
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- 05 Dec, 2009 3 commits
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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- 04 Dec, 2009 3 commits
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Mark Friedrichs authored
Removed static variables in CudaFreeEnergyKernels.cpp Moved declaration of global feSim to within method where actually used in kCalculateNonbondedSoftcore.cu
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Christopher Bruns authored
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Christopher Bruns authored
windows export macro on ReferenceFreeEnergyKernelFactory, to avoid link error on TestReferenceGBVISoftcoreForce
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- 03 Dec, 2009 3 commits
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John Chodera authored
Replace Platform::getPlatform by Platform::getPlatformByName where necessary, due to recently changed interface.
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Mark Friedrichs authored
Removed cruft from Cmake file Modified the way platform is specified in TstFreeEnergyCudaUsingParameterFile.cpp
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Peter Eastman authored
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- 02 Dec, 2009 4 commits
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Mark Friedrichs authored
Changed format from %u to %zu for size_t entries
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Peter Eastman authored
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Christopher Bruns authored
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Christopher Bruns authored
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- 01 Dec, 2009 9 commits
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Peter Eastman authored
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Christopher Bruns authored
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Peter Eastman authored
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Christopher Bruns authored
(It still *fails*, but at least it is found)
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Christopher Bruns authored
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Christopher Bruns authored
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- 30 Nov, 2009 1 commit
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Christopher Bruns authored
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- 27 Nov, 2009 1 commit
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Mark Friedrichs authored
Removed routines to copy forces: Peter pointed out a shallow copy using copy constructors is sufficient
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