Gromacs
2020.2
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Directories | |
directory | benchmark |
directory | cuda |
directory | kernels_reference |
directory | kernels_simd_2xmm |
directory | kernels_simd_4xm |
directory | opencl |
Files | |
file | atomdata.cpp |
file | atomdata.h |
file | boundingboxes.h |
file | clusterdistancekerneltype.h |
file | constants.h |
file | gpu_common.h |
file | gpu_common_utils.h |
file | gpu_data_mgmt.h |
Declare interface for GPU data transfer for NBNXN module. | |
file | gpu_jit_support.h |
file | gpu_types.h |
Sets gmx_nbnxn_gpu_t to the correct type depending on the build. | |
file | gpu_types_common.h |
file | grid.cpp |
file | grid.h |
file | gridset.cpp |
file | gridset.h |
file | gridsetdata.h |
file | kernel_common.cpp |
file | kernel_common.h |
file | kerneldispatch.cpp |
file | nbnxm.cpp |
file | nbnxm.h |
This file contains the public interface of the nbnxm module that implements the NxM atom cluster non-bonded algorithm to efficiently compute pair forces. | |
file | nbnxm_geometry.cpp |
file | nbnxm_geometry.h |
file | nbnxm_gpu.h |
Declare interface for GPU execution for NBNXN module. | |
file | nbnxm_setup.cpp |
file | nbnxm_simd.h |
file | pairlist.cpp |
file | pairlist.h |
file | pairlist_simd_2xmm.h |
file | pairlist_simd_4xm.h |
file | pairlist_tuning.cpp |
file | pairlist_tuning.h |
Declares functions for tuning adjustable parameters for the nbnxn non-bonded search and interaction kernels. | |
file | pairlistparams.cpp |
file | pairlistparams.h |
file | pairlistset.cpp |
file | pairlistset.h |
file | pairlistsets.h |
file | pairlistwork.h |
file | pairsearch.cpp |
file | pairsearch.h |
file | prunekerneldispatch.cpp |