[gmx-users] Using GPU to run gromacs 5.1.5

Sabreen Farnaz s.neelima531 at gmail.com
Thu May 17 17:18:58 CEST 2018

Dear all,

Currently I am using GPU acceleration to run Gromacs V5.1.5. Energy groups
are still not created for V5.1.5, similar to previous versions, with the
message "NOTE: With GPUs, reporting energy group contributions is not
supported". My question is if this is supported in more recent versions
like 2018.1 or if it will be implemented in future versions?

Neelima S.

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