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Marie-Madeleine Walz

  • Registered on: 10/17/2017
  • Last connection: 10/23/2017

Issues

Activity

10/23/2017

01:41 PM GROMACS Bug #2279 (Closed): gmx check
Using the tool "gmx check" comparing two .tpr files with different number of particles (e.g. ions):
For the .tpr ...
01:16 PM GROMACS Bug #2278 (Rejected): Mega - Flops accounting
In the .log file there is a the section called Mega-Flops accounting.
Comparing the values for M-Number and M-Folp...

10/17/2017

05:00 PM GROMACS Bug #2274 (Closed): Mega - Flops accounting
In the .log file there is a section called Mega-Flops accounting.
Here the "NB VdW [V&F]" counts also the polarizati...

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