[gmx-developers] g_hbond OpenMP parallelization only for ACF

Bin Liu fdusuperstring at gmail.com
Sat Aug 16 03:16:20 CEST 2014

Hi Everyone,

When I use g_bond with -nthreads 8 flag, and the output by g_bond indeed
shows "Frame loop parallelized with OpenMP using 8 threads", the system
monitor tells me g_hbond is still running single-threaded.

Is g_bond OpenMP parallelization only for ACF calculation? Or they are some
tricks involved to enable full OpenMP support?


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