[gmx-users] energy groups/GPU and 4.6 vs 5.0

[Josip Lovrić]

Hello,

I can maybe give you answer on second question. I have used analyzes tool
gmx gangle from 5.0-beta to analyzes trajectories from 4.6.5 and it was OK
for me.

Cheers,
Josip


2014-04-04 9:35 GMT+02:00 michael.b <mbx0009 at yahoo.com>:

>
> two questions:
>
> 1) searching this list if found this comment:
> "NOTE: With GPUs, reporting energy group contributions is not supported"
>
> this was true for version 4.6.1
> is it still the case for 4.6.5 and/or for 5.0-beta?
>
> 2) if i use mdrun-5.0-beta to analzye trajectories produced with 4.6.5
> do i have to expect any kind of issues?
>
> thanks!
> michael
>
>
>
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