Re: Configuration help, Cant get client folding
Posted: Thu Mar 23, 2017 4:31 pm
The max-packet-size is a separate parameter from the client-type setting of bigadv. It may make a difference with CPU projects if you are using the released client version 7.4.4. The definition of what the default "normal" sized WU is in MB was increased in the public-beta of 7.4.16.
As for PPD, some of the CPU projects currently available for larger numbers of cores scale up better than others. There are also some projects that have maximum core restrictions because there are insufficient atoms in the simulation to scale to a large number of cores. You will also see a difference between projects still using the older A4 core as compared to the A7 core. The A7 core is based on newer Gromacs code and will use AVX processing if available on your CPU, or SSE2 as compared to SSE used by A4.
As for PPD, some of the CPU projects currently available for larger numbers of cores scale up better than others. There are also some projects that have maximum core restrictions because there are insufficient atoms in the simulation to scale to a large number of cores. You will also see a difference between projects still using the older A4 core as compared to the A7 core. The A7 core is based on newer Gromacs code and will use AVX processing if available on your CPU, or SSE2 as compared to SSE used by A4.