Gromacs
2024.4
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Functions | |
template<typename ForceBufferElementType > | |
void | reduceThreadForceBuffers (ArrayRef< gmx::RVec > force, ArrayRef< std::unique_ptr< ThreadForceBuffer< ForceBufferElementType >>> threadForceBuffers, ArrayRef< const gmx_bitmask_t > masks, ArrayRef< const int > usedBlockIndices) |
Reduce thread-local force buffers into force (does not reduce shift forces) | |