- 23 Feb, 2010 1 commit
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Christopher Bruns authored
Modified Cuda FreeEnergy plugin to use a different windows export macro than main openmm library and cuda library. Modified CUDA_NVCC_FLAGS to be consistent with Peter's latest version in all three locations they are defined. Added "-Xcompiler '/MD'" to CUDA_NVCC_FLAGS on Windows to avoid link error in Cuda FreeEnergy plugin.
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- 19 Feb, 2010 1 commit
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Christopher Bruns authored
Export CudaFreeEnergyKernelFactory symbols to avoid link error in test program.
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- 26 Nov, 2009 1 commit
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Mark Friedrichs authored
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- 09 Nov, 2009 1 commit
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Mark Friedrichs authored
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- 03 Nov, 2009 1 commit
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Mark Friedrichs authored
Free energy plugin added Plugin will not run w/ Obc or GB/VI forces unless line 2004 of gpu.cpp (gpu->sim.totalNonbondOutputBuffers = 2*gpu->sim.nonbondOutputBuffers;) is commented in -- working on removing this constraint Also unit tests for GB/VI currently fail
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