[gmx-developers] New Command line checking

Dommert Florian dommert at icp.uni-stuttgart.de
Wed Apr 18 11:52:19 CEST 2012


currently I am polishing g_pme_error for the new release. Apart from a
complete new error estimate, which also applies to odd interpolation
orders, I have to include the new command line checking, but somehow I
got stuck there. The tool just requires a tpr as input, so if it is not
given, a fatal error will occurs.

Hence I assume the PCA_Flags should be:

PCA_Flags = (MASTER(cr) ? 0 : PCA_QUIET);

Is that correct ?



Florian Dommert
Dipl. - Phys.

Institute for Computational Physics
University Stuttgart

Pfaffenwaldring 27
70569 Stuttgart

EMail: dommert at icp.uni-stuttgart.de
Homepage: http://www.icp.uni-stuttgart.de/~icp/Florian_Dommert

Tel.: +49 - (0)711 - 68563613
Fax.: +49 - (0)711 - 68563658
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