- 24 Nov, 2009 3 commits
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Peter Eastman authored
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Peter Eastman authored
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Christopher Bruns authored
Set NVCC_FLAGS to particular value in new cmake_modules/FindCUDA.cmake
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- 23 Nov, 2009 5 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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Peter Eastman authored
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- 20 Nov, 2009 3 commits
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Mark Friedrichs authored
removed some cruft
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Peter Eastman authored
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Christopher Bruns authored
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- 19 Nov, 2009 12 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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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
Turn on free energy plugin by default. Better rule for when to default build OpenMM wrappers. Several tweaks to advanced vs. non-advanced cmake variables.
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Christopher Bruns authored
So nightly builds can build CUDA and API wrappers when prerequisites are present. While still being gentle on third party cmake builders. New cmake_modules directory contains FindCUDA.cmake from cmake 2.8.0, and Find OpenCL.cmake from platforms/OpenCL directory.
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Mark Friedrichs authored
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Mark Friedrichs authored
Fixed bug: was calling kReduceObcGbsaSoftcoreBornForces instead of kReduceGBVISoftcoreBornForces in GB/VI force calculation
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Mark Friedrichs authored
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- 18 Nov, 2009 13 commits
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Mark Friedrichs authored
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Mark Friedrichs authored
Mods to get Free energy plugin libs to compile on Windows; still problem w/ kCalculateLocalSoftcoreForces.cu and hence OpenMMFreeEnergyCuda lib
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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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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
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Mark Friedrichs authored
Added #include <typeinfo> to see if it removes errors associated w/ std::bad_cast on Linux Ubuntu 4.3.2
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Mark Friedrichs authored
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- 17 Nov, 2009 4 commits
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Peter Eastman authored
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Peter Eastman authored
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Mark Friedrichs authored
Changed ReferenceFreeEnergyPlatform name to ReferenceFreeEnergy Removed references to ParameterFileName in GB/VI
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Peter Eastman authored
Redesigned CustomNonbondedForce to eliminate combining rules and allow the expression to directly use parameters for individual particles.
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