RDkit Discussion Group,
I am running the RDkit diverse max min picker code on my WINDOWS 7
64 bit 4 dual core I7 computer. I have tested the code on a small set of
compounds
and the results are OK.
I am now running diverse subset picking on an SDF containing about 40k
compounds. The CPU usage across all 8 CPUs is about 14 - 15 %. Are there
any flags or parameters that can be set in the PYTHON or RDkit code to get
more CPU utilization? Thank you.
Jim Metz
Metz Research LLC
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