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is this model can use multi cpu for relaxing? #60

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sunjiwon opened this issue Mar 2, 2023 · 0 comments

sunjiwon commented Mar 2, 2023 •

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when i use the this code, the cpu load is always equal when allocate 32 core and 1 core.
i think this code is run using in 1 core-cpu.

please let me know 'how to use multi-threading in your code'
is it faster using gpu in Relaxing code?

from m3gnet.models import Relaxer
relaxer = Relaxer()
relax_results = relaxer.relax(candidate_structure[0], verbose=True, steps=2000, interval=20, )

Thank you for creating such an amazing code.

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