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Szilárd Páll

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12/10/2017

11:38 AM GROMACS Revision 969fb1d0: Disable default-on NVML support in CMake
Due to the problems related to NVML builds failing in link stage when
linking against stub libs, we disable NVML by d...

12/08/2017

06:07 PM GROMACS Bug #2322: CUDA-enabled mdrun reports error in CPU runs on non-GPU host
Mark Abraham wrote:
> The note and error happen also with @-nb auto@ where it is clearly appropriate to run the dete...

12/06/2017

12:24 AM GROMACS Bug #2300: Intel compiler warnings
Thanks for the fix. I was going to check how much does @-qoverride-limits@ impact compile time. Have you checked? Is ...
06:03 PM GROMACS Bug #2311: NVML compilation issues
...
05:52 PM GROMACS Bug #2311: NVML compilation issues
Szilárd Páll wrote:
> Christoph Junghans wrote:
> > Can you do a
> > [...]
> [...]
I do not think NVML is a de...
05:50 PM GROMACS Bug #2311: NVML compilation issues
Christoph Junghans wrote:
> Can you do a
> [...]...
05:18 PM GROMACS Bug #2311: NVML compilation issues
This is the link error I get:...
04:39 PM GROMACS Bug #2329 (Resolved): compiler warning with gcc 4.8
02:34 AM GROMACS Task #2249: Clarify rounding of SIMD round
Set target to beta3 as proposed implementation does not have approval yet.
02:10 AM GROMACS Revision 27eef472: Implement alternating GPU wait
When both PME and nonbonded tasks are offloaded, instead of waiting in a
blocking call for each task in a predefined ...

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