[gmx-developers] Code exploration
nt_mahmood at yahoo.com
Sat Aug 18 12:04:36 CEST 2018
Still I am not sure if I am in the right direction. Any guess?
On Sunday, July 29, 2018, 3:59:13 PM GMT+4:30, Mahmood Naderan <nt_mahmood at yahoo.com> wrote:
I would like to explore the code to inject some custom profiling routines. As I see the output, I see
step 1800: timed with pme grid 60 80 60, coulomb cutoff 1.037: 2793.4 M-cycles
optimal pme grid 60 80 60, coulomb cutoff 1.037
NOTE: DLB can now turn on, when beneficial
step 6900, remaining wall clock time: 29 s imb F 3%
So, where in the code, such a switch happens? I mean the code which is run after the calculation of optimal pme. I think the location is
Am I right?
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