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Title: Can RASPA achieve multi-core computing
Post by: dandelion_777 on May 07, 2021, 03:22:15 AM

Hello,

I want to know whether RASPA can compute with multi-core (for Molecular Dynamics), as i have a 6-core system (each with 2 thread), i want a accelerated computing . If RASPA can achieve this , what command should i use ?

Thank you,
Yang

Title: Re: Can RASPA achieve multi-core computing
Post by: David Dubbeldam on May 21, 2021, 06:41:42 PM

No. For MD, you're better off using LAMMPS which is parallel and very fast.

Title: Re: Can RASPA achieve multi-core computing
Post by: dandelion_777 on May 24, 2021, 11:31:52 AM

Thanks for your reply!

Best wishes,
Yang

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RASPA => Simulation algorithms and theory => Topic started by: dandelion_777 on May 07, 2021, 03:22:15 AM